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1-プロパノール

1-Propanol

HCID 1031
ノートを作成反応を作成見積依頼を出す
印刷プレビュー
基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
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基本情報

CAS
71-23-8
標準SMILES
CCCO
InChIKey
BDERNNFJNOPAEC-UHFFFAOYSA-N
分子式
C3H8O
平均分子量
60.1 g/mol
単同位体質量
60.05751487

概要

N-propanol appears as a clear colorless liquid with a sharp musty odor like rubbing alcohol. Flash point 53-77 °F. Autoignites at 700 °F. Vapors are heavier than air and mildly irritate the eyes, nose, and throat. Density approximately 6.5 lb / gal. Used in making cosmetics, skin and hair preparations, pharmaceuticals, perfumes, lacquer formulations, dye solutions, antifreezes, rubbing alcohols, soaps, window cleaners, acetone and other chemicals and products.

名称と識別子

優先名称
1-Propanol
IUPAC
propan-1-ol
現地名
1-プロパノール
英語名
1-Propanol
分子式
C3H8O
分子量
60.1

名称と別名

1-propanolpropanolPropyl alcoholPropan-1-oln-propanol71-23-8n-Propyl alcoholethylcarbinoloptalosmosol extraPropylic alcoholPropanol-1
名称をさらに表示
1-プロパノールn-プロパノール1-ヒドロキシプロパンオスモソールエクストラプロパノールプロパン-1-オールn-プロピルアルコールプロピルアルコールオプタール1-プロパノル1-プロパノ-ル1プロパノルn-プロピルアルコール(1-プロパノール)ノルマル-プロピルアルコール1‐プロパノール1-プロパノール ≥99% (GC),PURUM1-プロパノール ACS REAGENT,≥99.5%1-プロパノール PURISS. P.A.,REAG. PH. EUR.,≥99.5% (GC)1-プロパノール クロマソルブ,FOR HPLC,≥99.9%1-プロパノールN-プロピルアルコールn-PrOHFEMA 2928n-propano
1-Propyl alcoholn-Propan-1-olPropanolePropanolenAlcohol, propylPropanoliEthyl carbinolAlcool propilico

データベース識別子

CAS
71-23-8
PubChem CID
1031
DTXSID
DTXSID2021739
ChEMBL
CHEMBL14687
ChEBI
CHEBI:28831
UNII
96F264O9SV
EC Number
200-746-9
Nikkaji
J1.422B

物性

構造計算による物性

XLogP
0.3
極性表面積
20.2 Ų
水素結合供与体数
1
水素結合受容体数
1
回転可能結合数
1
重原子数
4
形式電荷
0
複雑度
7.2

実験および物理化学的性質

Chemical ClassesFlammable agents - 3rd degree
DrugsPharmaceuticals -> Listed in ZINC15
LipidsFatty Acyls [FA] -> Fatty alcohols [FA05]
SolventsSolvents -> Alcohols (<C12)
Cosmetics · 2 件

Cosmetic ingredients (Propyl Alcohol) -> CIR (Cosmetic Ingredient Review)

Solvent; Antifoaming

SpringerMaterials PropertiesCoriolis coupling
FragrancesFragrance Ingredient (Propyl alcohol) -> IFRA transparency List
LogP · 4 件

log Kow= 0.25

0.25

0.25

0.28

Odor · 2 件

Similar to ethanol

Odor perception threshold: <0.07-100 mg/cu-m; odor recognition threshold: 0.32-150 mg/cu m

Taste · 3 件

CHARACTERISTIC RIPE, FRUITY FLAVOR

Taste detection: 7.50X10+3 ppm, purity of sample not specified

Burning taste

安全と法規制

安全情報は参考情報です。供給元の安全データシート(SDS)、適用法令、専門家による評価に代わるものではありません。

GHS分類

GHS Classification · 6 件

Danger

H225: Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264+P265, P271, P280, P303+P361+P353, P304+P340, P305+P354+P338, P317, P319, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

This chemical does not meet GHS hazard criteria for < 0.1% (1 of 3950) of reports.

Danger

H225 (> 99.9%): Highly Flammable liquid and vapor [Danger Flammable liquids]

危険有害性情報

Regulatory Information · 6 件

Chemical: 1-Propanol

Regulation (EC) No 178/2002 (amended)

1-Propanol is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Propanol are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

REACH registered substance: Propan-1-ol (EC: 200-746-9)

1-Propanol: HSNO Approval: HSR001215 Approved with controls

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

Other Safety InformationIMAP assessments - 1-Propanol: Environment tier I assessment
DOT LabelFlammable Liquid
Fire Hazards · 4 件

Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:

· HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames.

· HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames.

Highly flammable. Vapour/air mixtures are explosive. Risk of fire and explosion on contact with strong acids or strong oxidants.

Fire Potential · 2 件

化学と産業

薬理情報

ATC Code · 3 件

D08AX03

D - Dermatologicals

QD - Dermatologicals

Biological Half-LifeNo reports found; [TDR, p. 1052]
Metabolism/Metabolites · 5 件

... PROPANOL ... MAY FORM ETHEREAL ... /SULFATE/

1-PROPANOL IS METABOLIZED BY THE ENZYME ALCOHOL DEHYDROGENASE. IT IS READILY OXIDIZED IN THE BODY, FIRST TO PROPIONIC ACID AND THEN TO CARBON DIOXIDE, WATER AND PERHAPS A SMALL AMOUNT OF LACTIC ACID.

... HEPATIC MICROSOMES CATALYZED THE OXIDATION OF PROPANOL TO ITS ALDEHYDE IN THE RAT. THE REACTION REQUIRED OXYGEN & NICOTINAMIDE-ADENINE DINUCLEOTIDE PHOSPHATE, WAS INHIBITED BY CARBON DIOXIDE AND ACTED INDEPENDENTLY OF CATALASE & ALCOHOL DEHYDROGENASE.

Cytochrome p450 isozyme 3a, isolated from hepatic microsomes of rabbits treated chronically with ethyl alcohol, had a unique substrate specificity when compared with isozymes 2, 3b, 3c, and 4. Form 3a has unusually high activity in the p-hydroxylation of aniline and in the oxidation of alcohols to aldehydes. Isozyme 3a catalyzes the oxidation of methyl alcohol, propyl alcohol, and butanol as well as ethyl alcohol.

For more Metabolism/Metabolites (Complete) data for N-PROPANOL (6 total), please visit the HSDB record page.

Absorption, Distribution and Excretion · 4 件

PROPANOL-1 IS ABSORBED FROM GI TRACT & LUNGS. IT CAN BE ABSORBED FROM THE SKIN IF A SIGNIFICANT AMOUNT IS CONFINED TO THE SKIN. 1-PROPANOL IS ABSORBED MORE READILY THAN ETHANOL. ...

... USING ABDOMINAL AUTOPSY /HUMAN/ SKIN IN A DIFFUSION CHAMBER ... 1-PROPANOL PENETRATED THE SKIN MORE RAPIDLY FROM SOLUTION IN NONPOLAR SOLVENTS SUCH AS ISOPROPYL PALMITATE, OLIVE OIL, & MINERAL OIL THAN FROM SOLUTION IN SALINE.

FOLLOWING AN ORAL DOSE OF 2 G/KG TO RATS, 0.13% OF THE DOSE WAS EXCRETED IN THE URINE. ... 1.65% /WAS/ EXCRETED IN THE EXPIRED AIR & 0.7% EXCRETED IN THE URINE FOLLOWING AN ORAL DOSE OF 2 ML/KG TO RABBITS.

Urine was analyzed immediately, 1, 2, 8, and 9 hr after drinking (during 2 hr) 3.75 ml/kg of beverages containing orange juice, 15 or 40% ethanol, and and 1 g/l of 1-propanol, 2-propanol, 1-butanol, 2-butanol, isobutyl alcohol or a mixture of 1-propanol & isobutyl alcohol. Maximum urine levels /in mg/l/ were found 1 hr after drinking ended: 1-propanol 5.04, 2-propanol 3.36, 1-butanol 0.43, 2-butanol 2.55, isobutyl alcohol ... 1.7-2.03 mg/l. Urine treatment with beta-glucuronidase before analysis indicated that significant amounts of the alcohols were excreted as glucuronides, esp isobutyl alcohol. 2-Propanol and 2-butanol were the slowest to be metabolized. When mixtures of alcohols were given, the concentrations of isobutyl alcohol glucuronides were high with the mixtures containing 5 and 15% ethanol, and decreased at 40% ethanol.

関連反応

1,906 件
反応記録を作成
HRID 2661 の反応式
HRID 2661溶媒としてuspto-grants-1998_03
HRID 2662 の反応式
HRID 2662溶媒としてuspto-grants-1998_03
HRID 2663 の反応式
HRID 2663溶媒としてuspto-grants-1998_03
HRID 2664 の反応式
HRID 2664溶媒としてuspto-grants-1998_03
HRID 2665 の反応式
HRID 2665溶媒としてuspto-grants-1998_03
HRID 2666 の反応式
HRID 2666溶媒としてuspto-grants-1998_03
HRID 2667 の反応式
HRID 2667溶媒としてuspto-grants-1998_03
HRID 4698 の反応式
HRID 4698反応物としてuspto-grants-1988_02
1 / 239 ページ

化合物ノート

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このページの内容基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
その他の操作
ノートを作成反応を作成見積依頼を出す
Food Additives
FLAVORING AGENT OR ADJUVANT, SOLVENT OR VEHICLE -> FDA Substance added to food
Density · 6 件

0.803 at 68 °F (USCG, 1999) - Less dense than water; will float

0.8053 @ 20 °C/4 °C

% IN "SATURATED" AIR: 2.7 (25 °C); DENSITY OF "SATURATED" AIR: 1.028 (AIR= 1) @ 25 °C; 1 MG/L= 408 PPM & 1 PPM= 2.45 MG/CU M @ 25 °C, 760 MM HG

Coefficient of cubical expansion: 9.56X10-7 at 0-94 °C; critical density: 0.2734; electrical conductivity: 2X10-3 mho/cm at 25 °C; specific heat: 0.586 cal/g/deg C at 25 °C; wt/gal: 6.7 lb at 20 °C

Heat capacity, liquid @ 25 °C = 141 J/mol-K; flash point, Tag open cup = 28.9 °C; autoignition temp = 371.1 °C; explosive limit, in air = 2.2 vol% (lower), 14.0 vol% (upper); electrical conductivity @ 25 °C = 2X10-8 mho; critical density = 0.275 g/cu-cm

Relative density (water = 1): 0.8 (20 °C)

物理化学的性質

融点
-127 °C · -127 °C(lit.)
沸点
97 °C · 97 °C(lit.)
比重(密度)
0.804 g/mL · 0.804 g/mL at 25 °C(lit.)
蒸気密度
2.1 · 2.1 (vs air)
蒸気圧
10 mm · 10 mm Hg ( 147 °C)
屈折率
20 · n20/D 1.384(lit.)
FEMA
2928 · 2928 | PROPYL ALCOHOL
闪点
59 °F · 59 °F
貯蔵温度
5 °C · Store at +5°C to +30°C.
溶解性
2 O: · H2O: テストに合格
外見
液体
酸解離定数(Pka)
14 · >14 (Schwarzenbach et al., 1993)
色
10 · <10(APHA)
PH
7 · 7 (200g/l, H2O, 20℃)
臭い (Odor)
エチルアルコールに似ています。
由来生物
synthetic
臭気閾値(Odor Threshold)
0.094 ppm · 0.094ppm
においのタイプ
アルコール依存症
爆発限界(explosive limit)
2.1 · 2.1-19.2%(V)
水溶解度
溶ける
比熱容量
2.39 J/ · Cp(liquid): 2.39 J/(g·K); Cp(gas): 1.42 J/(g·K), at 25℃
JECFA Number
82 · 82
Merck
14 · 14,7842
BRN
1098242 · 1098242
Henry's Law Constant
6.75 · 6.75 (static headspace-GC, Merk and Riederer, 1997)
Dielectric constant
20.1 · 20.1(25℃)
安定性
安定。空気と接触すると、過酸化物が形成される場合があります。アルカリ金属、アルカリ土類金属、アルミニウム、酸化剤、ニトロ化合物とは混和しません。とても燃えやすい。蒸気/空気混合物は爆発性です。
主な用途
フレーバーそして香料
化粧品成分の機能
溶媒消泡剤
InChI
1S/C3H8O/c1-2-3-4/h4H,2-3H2,1H3
InChIKey
BDERNNFJNOPAEC-UHFFFAOYSA-N
SMILES
CCCO
LogP
0.33 · 0.33
表面張力
23.7 mN/m · 23.7mN/m at 293.15K
CAS データベース
71 · 71-23-8(CAS DataBase Reference)
NISTの化学物質情報
1 · 1-Propanol(71-23-8)
EPAの化学物質情報
1 · 1-Propanol (71-23-8)
化学的性質 · 2 件

化学的特性プロパノールC3H8Oはアルコールの一種であり透明で揮発性の高い液体ですこの化合物は主に二つの異性体すなわち1プロパノールと2プロパノール別名イソプロパノールとして存在しますプロパノールは溶剤消毒剤化学合成の原料など多岐にわたる用途で使用されています

化学的特性1-Propanol is a clear, colorless liquid with an alcoholic odor and a characteristic ripe, fruity flavor. It is soluble in water and miscible with organic solvents (Propanols). It has better dissolution properties than ethanol for fats and oils, and dissolves polar resins in the same way as ethanol. Cellulose nitrate and poly(vinyl acetate) are, however, almost insoluble. For economic reasons propanol is of only limited use as a solvent, and is a starting material for esters.

Dangerous upon exposure to heat or flame; can react vigorously with oxidizing materials.

Ignites on contact with potassium-tert-butoxide.

Health Hazards · 3 件

Contact with eyes is extremely irritating and may cause burns. Vapors irritate nose and throat. In high concentrations, may cause nausea, dizziness, headache, and stupor. (USCG, 1999)

· May cause toxic effects if inhaled or absorbed through skin.

· May cause toxic effects if inhaled or absorbed through skin.

Hazards Summary · 1 件

A mucous membrane irritant similar to isopropyl alcohol, n-propyl alcohol produces narcosis in animals inhaling high concentrations. It causes severe liver injury in chronic feeding studies of laboratory animals. [ACGIH] Irritating to the eyes; Inhalation of high concentrations can cause CNS depression; [ICSC]

DOT ID and Guide · 3 件

1274 129

1274 129

1274 129

FDA Requirements · 3 件

Propyl alcohol is a food additive permitted for direct addition to food for human consumption as a synthetic flavoring substance and adjuvant in accordance with the following conditions: a) they are used in the minimum quantity required to produce their intended effect, and otherwise in accordance with all the principles of good manufacturing practice, and 2) they consist of one or more of the following, used alone or in combination with flavoring substances and adjuvants generally recognized as safe in food, prior-sanctioned for such use, or regulated by an appropriate section in this part.

Propyl alcohol is an indirect food additive for use only as a component of adhesives.

Normal propyl alcohol may be safely used in feeds and feed supplements for cattle as a source of metabolizable energy. It is incorporated in the fed or feed supplement in an amount which provides not more than 54.5 g of the additive per head per day.

Reactive GroupAlcohols and Polyols
UN ClassificationUN Hazard Class: 3; UN Pack Group: II
EPA Safer ChemicalChemical: Propyl alcohol

安全と保護具

Fire Fighting · 2 件

Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:

Use water spray, powder, alcohol-resistant foam, carbon dioxide. In case of fire: keep drums, etc., cool by spraying with water.

First Aid Measures · 4 件

Fresh air, rest.

First rinse with plenty of water for at least 15 minutes, then remove contaminated clothes and rinse again.

Rinse with plenty of water for several minutes (remove contact lenses if easily possible). Refer immediately for medical attention.

Rinse mouth. Do NOT induce vomiting. Refer immediately for medical attention.

Accidental Release Measures · 4 件

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

First Aid · 4 件

Excerpt from NIOSH Pocket Guide for n-Propyl alcohol:

General First Aid:

General First Aid:

(General first aid procedures)

Safe StorageSeparated from strong oxidants and strong acids. Well closed. Fireproof. Cool. Ventilation along the floor.
Firefighting HazardsFlash back along vapor trail may occur.
Exposure Control and Personal Protection · 2 件

· Wear positive pressure self-contained breathing apparatus (SCBA).

· Wear positive pressure self-contained breathing apparatus (SCBA).

Fire Fighting Procedures · 2 件

To fight fire use alcohol foam, carbon dioxide, dry chemical.

/During/ fire fighting self-contained breathing apparatus with full facepiece operated in pressure demand or other positive pressure mode /should be worn./

Storage ConditionsKeep containers closed, store in cool, well ventilated place away from ignition sources.
Cleanup Methods · 2 件

Absorb on paper. Evaporate on a glass or iron dish in hood. Burn the paper.

Countermeasures recommended for treating spills: activated charcoal, biological treatment agent, gelling agent, absorbing agent, dispersing agent.

Nonfire Spill ResponseExcerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
Disposal Methods · 4 件

SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.

1. By absorbing it in vermiculite, dry sand, earth or a similar material and disposing in an ... /approved/ sanitary landfill. 2. By atomizing in a suitable combustion chamber.

The following wastewater treatment technologies have been investigated for n-propanol: Biological treatment.

Incineration: Waste liquid can be atomized in an incinerator or can be disposed of by way of a licensed solvent disposal company or can be reclaimed.

毒性情報

Toxicological InformationRanking: 569 (total points: 150.47999999999999)
Body Burden · 1 件

n-Propanol was detected in 1 of 12 samples of mother's milk from 4 urban areas in the United States(1). The avg and range of n-propanol concns in human breath due to metabolic processes is 130 ug/cu-m and not detected-1,270 ug/cu m (8 subjects in zero air), respectively (2).

Interactions · 4 件

N-PROPANOL INHIBITED N-NITROSODIMETHYLAMINE METABOLISM IN ISOLATED PERFUSED RAT LIVER.

IN VITRO ... WITH RAT LIVER SLICES BIOTRANSFORMATION OF CHLORAL HYDRATE TO TRICHLOROETHANOL WAS FOUND TO BE ENHANCED MORE EFFECTIVELY BY N-PROPANOL AND N-BUTANOL THAN BY ETHANOL ...

ADDING 1 G/L OF PROPAN-1-OL, PROPAN-2-OL, BUTAN-1-OL, BUTAN-2-OL, ISOBUTANOL TO 40% ETHANOL IN ORANGE JUICE LOWERED AND DELAYED BLOOD ETHANOL MAX IN 10 20-30 YR-OLD MEN WHO DRANK 3.75 ML/KG OF SYNTHETIC BEVERAGE.

CUTANEOUS REACTIONS TO N-PROPANOL WERE EVALUATED IN A CONTROL GROUP & IN PATIENTS BEFORE & DURING RECEIPT OF DISULFIRAM THERAPY. LOCAL CUTANEOUS ERYTHEMA WAS OBSERVED FROM PATCH TESTS WITH N-PROPANOL IN HYDRATED SKIN. SINCE REACTIONS NOTED FROM TOPICALLY APPLIED ALCOHOLS BEFORE & DURING DISULFIRAM THERAPY WERE NOT STATISTICALLY DIFFERENT, A LOCALIZED DISULFIRAM-ALCOHOL REACTION IS UNLIKELY. ERYTHEMA RESULTING FROM TOPICALLY APPLIED ALCOHOLS OCCURRED IN A DOSE RELATED MANNER & WAS CAUSED BY A DIRECT VASODILATORY EFFECT ON THE CUTANEOUS MICROVASCULATURE.

Target OrgansEyes, skin, respiratory system, gastrointestinal tract, central nervous system
Ecotoxicity Values · 5 件

LC50 Pimephales promelas (fathead minnows) 4.48 g/l/96 hr (95% confidence limit 4.10-4.88 g/l); age 30 days old, water hardness 47.0 mg/l (CaCO3), temp 27.7 °C, pH 7.40, dissolved oxygen 5.4 mg/l, alkalinity 43.0 mg/l (CaCO3), tank vol: 1.0 l, additions: 36 vol/day (flow-through bioassay)

LC50 Ambystoma mexicanum (Mexican axolotl) 4000 mg/l/48 hr (3-4 wk after hatching) /Conditions of bioassay not specified/

LC50 Clawed toads 4000 mg/l/48 hr (3-4 wk after hatching) /Conditions of bioassay not specified/

LD100 Semotilus atromaculatus (creek chub) 500 mg/l/24 hr in Detroit river water /Conditions of bioassay not specified/

For more Ecotoxicity Values (Complete) data for N-PROPANOL (9 total), please visit the HSDB record page.

Environmental Fate · 3 件

TERRESTRIAL FATE: Based on a classification scheme(1), a Koc value of 33(SRC) determined from a log Kow of 0.25(2), and a regression-derived equation(3), indicates that n-propanol is expected to have very high mobility in soil(SRC). Volatilization of n-propanol from moist soil surfaces is expected to be an important fate process(SRC) given a Henry's Law constant of 7.41X10-6 atm-cu m/mole(4). The potential for volatilization of n-propanol from dry soil surfaces may exist(SRC) based upon a vapor pressure of 21 mm Hg(5). n-Propanol is readily degraded in aerobic systems(6-9); the range of half-lives for aerobic degradation using a sewage sludge inoculum are <1 day to 11 days(SRC). n-Propanol has also been shown to be readily degraded under anaerobic conditions(9).

AQUATIC FATE: Based on a classification scheme(1), an estimated Koc value of 33(SRC), determined from an measured log Kow of 0.25(2) and a regression-derived equation(3), indicates that n-propanol is not expected to adsorb to suspended solids and sediment(SRC). Volatilization from water surfaces is expected(3) based upon a Henry's Law constant of 7.41X10-6 atm-cu m/mole(4). Using this Henry's Law constant and an estimation method(3), volatilization half-lives for a model river and model lake are 62 hours and 31 days, respectively(SRC). According to a classification scheme(5), an estimated BCF of 3(SRC) from a log Kow(2) and a regression-derived equation(6), suggests the potential for bioconcentration in aquatic organisms is low(SRC). n-Propanol is readily degraded in aerobic systems(7-10); the range of half-lives for aerobic degradation using a sewage sludge inoculum are <1 day to 11 days(SRC). n-Propanol has also been shown to be readily degraded under anaerobic conditions(10).

ATMOSPHERIC FATE: According to a model of gas/particle partitioning of semivolatile organic compounds in the atmosphere(1), n-propanol, which has a vapor pressure of 21.0 mm Hg at 25 °C(2), is expected to exist solely as a vapor in the ambient atmosphere(SRC). Vapor-phase n-propanol is degraded in the atmosphere by reaction with photochemically-produced hydroxyl radicals(SRC); the half-life for this reaction in air is estimated to be 2.9 days(SRC), calculated from its rate constant of 5.53X10-12 cu cm/molecule-sec at 25 °C(3).

Food Survey Values · 1 件

Alcoholic beverages nearly always contain n-propanol as a product of fermentation(1). Beer contains up to 195 mg/l, wine up to 116 mg/l, various types of spirits up to 3520 mg/l, and neat ethanol up to 2910 mg/l(1). n-Propanol is present at low levels as a flavor volatile in a variety of foodstuffs and non-alcoholic drinks, eg: kefir culture, cream culture, filberts (roasted), raw milk, heat-treated milk, Kumazasa Sasa albomarginata, heated triolein, boiled buckwheat flour, tomato (ripe, juice, puree, and paste), Kogyoku apple, apple and apple juice, white bread, butter, cheddar/Swiss cheese, soy sauce, fish sauce, pigweed, winged bean (raw/roasted), soybean (raw, roasted), potato tuber, roasted watermelon seeds, babco fruit, tilsit cheese, endive, Valancia orange juice(1).n-Propanol was identified in fermentation brine of pimentos used for stuffing olives(2). n-Propanol was found in 31 commercial brines - 180 to 380 mg n-propanol/l ethyl alcohol; Cahors wine: 33 mg n-propanol/l wine; Corbiers wine: 12 mg n-propanol/l wine; Jamaican Rum: 31,300 mg n-propanol/l ethyl alcohol(2). The mean concn of n-propanol in headspace volatiles of Cabernet Sauvignon wines from the Napa Valley, CA ranged from 0.001 to 0.778 mg/l(3). n-Propanol has been detected (not quantified) in milk products including kefir and yogurt, and traces have been detected in fermented eggs(4). The range of concns of n-propanol in the volatile components of orange juices were 50-1140 ppb(5).

Adverse EffectsNeurotoxin - Acute solvent syndrome
Exposure Routes · 2 件

The substance can be absorbed into the body by inhalation of its vapour, by ingestion and through the skin.

inhalation, skin absorption, ingestion, skin and/or eye contact

Milk Concentrationsn-Propanol was detected in 1 of 12 samples of mother's milk from 4 urban areas in the United States(1).
Toxicity SummarySafe in the present practices of use and concentration. Ingredient, concentration, and use information are available in documents discoverable at https://cir-reports.cir-safety.org
Signs and Symptoms · 4 件

Dizziness. Drowsiness. Headache. Nausea. Weakness. Incoordination. Confusion.

Redness. Pain. Blurred vision.

Aspiration hazard! Abdominal pain. Sore throat. Vomiting. See Inhalation.

irritation eyes, nose, throat; dry cracking skin; drowsiness, headache; ataxia, gastrointestinal pain; abdominal cramps, nausea, vomiting, diarrhea; In Animals: narcosis

法規制情報

FDA Requirements · 3 件

Propyl alcohol is a food additive permitted for direct addition to food for human consumption as a synthetic flavoring substance and adjuvant in accordance with the following conditions: a) they are used in the minimum quantity required to produce their intended effect, and otherwise in accordance with all the principles of good manufacturing practice, and 2) they consist of one or more of the following, used alone or in combination with flavoring substances and adjuvants generally recognized as safe in food, prior-sanctioned for such use, or regulated by an appropriate section in this part.

Propyl alcohol is an indirect food additive for use only as a component of adhesives.

Normal propyl alcohol may be safely used in feeds and feed supplements for cattle as a source of metabolizable energy. It is incorporated in the fed or feed supplement in an amount which provides not more than 54.5 g of the additive per head per day.

FIFRA Requirements · 3 件

Residues of n-propanol are exempted from the requirement of a tolerance when used as a solvent or cosolvent in accordance with good agricultural practice as inert (or occasionally active) ingredients in pesticide formulations applied to growing crops or to raw agricultural commodities after harvest.

n-Propanol is exempted from the requirement of a tolerance when used as a solvent for blended emulsifiers in accordance with good agricultural practice as inert (or occasionally active) ingredients in pesticide formulations applied to growing crops only.

n-Propanol is exempted from the requirement of a tolerance when used as a solvent for blended emulsifiers in accordance with good agricultural practice as inert (or occasionally active) ingredients in pesticide formulations applied to animals.

Atmospheric Standards · 1 件

This action promulgates standards of performance for equipment leaks of Volatile Organic Compounds (VOC) in the Synthetic Organic Chemical Manufacturing Industry (SOCMI). The intended effect of these standards is to require all newly constructed, modified, and reconstructed SOCMI process units to use the best demonstrated system of continuous emission reduction for equipment leaks of VOC, considering costs, non air quality health and environmental impact and energy requirements. n-Propyl alcohol is produced, as an intermediate or a final product, by process units covered under this subpart.

安全データ

F
10-23
OEB
A
OEL
TWA: 200 ppm (500 mg/m3), STEL: 250 ppm (625 mg/m3) [skin]
wgk
1
IDLA
800 ppm
tsca
TSCA listed
rtecs
UH8225000
ridadr
UN 1274 3/PG II/III (n-PROPANOL (PROPYL ALCOHOL, NORMAL))
毒性
LD50 orally in rats: 1.87 g/kg (Smyth)
hs_code
29051200
risk_code
11-41-67
化審法
(2)-207
安衛法
57,57-2
消防法
危険物第4類アルコール類
hazard_code
F,Xi
safety_code
7-16-24-26-39
hazard_class
3
packing_group
II
自然発火温度
700 °F
環境リスク評価
1-プロパノール(71-23-8)
Hazard Classifications
Eye Dam. 1Flam. Liq. 2STOT SE 3
ストレージクラス
3 - Flammable liquids
有毒物質データの
71-23-8(Hazardous Substances Data)
Tissue LocationsFibroblasts
Metabolite PathwaysSulfite oxidase deficiency

用途と製造

Uses · 6 件

CIR ingredient: Propyl Alcohol

Used as a solvent, antiseptic, and chemical intermediate; [ACGIH] Used as a solvent in inks, pesticides, and lacquers; [HSDB]

Metal Degreasing [Category: Clean]

For n-Propanol (USEPA/OPP Pesticide Code: 047502) there are 0 labels match. /SRP: Not registered for current use in the U.S., but approved pesticide uses may change periodically and so federal, state and local authorities must be consulted for currently approved uses./

Solvent for natural gums, polyvinyl butyral, polishes, pharmaceuticals; in lacquers and dopes, cosmetics, dental lotions

Solvent; chemical intermediate; specialty solvent in flexographic printing inks particularly for printing on polyolefin and polyamide film; mfg of n-propyl acetate, n-propylamines, glycol ethers; as a ruminant feed supplement; flavor and fragrance in foods; solvent or cosolvent in pesticide formulations.

Impurities · 2 件

Sales specifications: water (0.1 wt%), acidity (0.003 wt% as acetic acid); 2-methylpentanal (10 ppm)

Water (< or = 0.1 wt%); aldehydes (< or = 0.2 wt%); ethanol (< or = 10 mg/kg); methanol (< or = 100 mg/kg)

U.S. Exports · 4 件

(1978) 1.28X10+10 G

(1982) 1.51X10+10 G

(1987) 4.30X10+7 lb

(1988) 5.12X10+7 lb

U.S. Imports · 3 件

(1978) 4.55X10+6 G

(1982) 2.95X10+7 G

(1986) 2.86X10+5 lb

U.S. Production · 6 件

2023: 550,000,000 - <700,000,000 lb

(1978) 7.37X10+10 G

(1982) 5.79X10+10 G

(1985) 1.45X10+6 lb

(1987) 1.86X10+8 lb

In 1993 (worldwide): 110,000 tons/yr

Consumption Patterns · 2 件

CHEM INT FOR N-PROPYLAMINES, 37%; SOLVENT, 23%; CHEM INT FOR N-PROPYL ACETATE, 18%; FEED ADDITIVE FOR CATTLE, 3%; CHEM INT FOR OTHER CHEMICALS, 19% (1980)

Flexographic printing inks(40%); mfg of n-propyl acetate(33%) n-propylamines(18%), and glycol ethers(12%).

Consumer UsesSolvent
Industry UsesNot Known or Reasonably Ascertainable
Methods of Manufacturing · 5 件

... obtained ... /from crude fusel oil/ by fractionation; available as byproduct of reaction between carbon monoxide and hydrogen.

It is by-product of the synthesis of methyl alcohol by high pressure & in the propane/butane oxidation process.

CAN BE ISOLATED FROM HEAD FRACTIONS DURING DISTILLATION OF WINE ... OR FROM TAIL FRACTIONS DURING RECTIFICATION OF SPIRITS.

The production of n-propanol by hydroformulation or oxo technology is a two step process in which ethylene is first hydroformulated to propanal; the resulting propanal is hydrogenated to n-propanol.

n-Propanol is one of the products from Sasol's Fischer-Tropsch process. Coal is gasified...to produce synthesis gas /which is catalyzed by a powdered iron-based catalyst to produce/ a mixture of hydrocarbons and oxygenates. The alcohol streams are further purified by distillation to yield pure n-propanol.

Household ProductsInformation on 18 consumer products that contain Propanol in the following categories is provided:
Use Classification · 6 件

EPA Safer Chemical Functional Use Classes -> Solvents

Safer Chemical Classes -> Green half-circle - The chemical is expected to be of low concern

Fragrance Ingredients

Flavouring Agent -> FLAVOURING_AGENTFood Additives -> CARRIER_SOLVENT; EXTRACTION_SOLVENT -> JECFA Functional Classes

Flavoring Agents -> JECFA Flavorings Index

Flavouring Agent -> FLAVOURING_AGENTFood Additives -> CARRIER_SOLVENT; EXTRACTION_SOLVENT -> JECFA Functional Classes

General Manufacturing Information · 2 件

Pharmaceutical and Medicine Manufacturing

1-Propanol: ACTIVE

応用分野 · 8 件

解説1-プロパノール,エタノールに似た香りをもつ無色の液体.融点-126.2 ℃,沸点97.21 ℃.d254 0.79948.n25D 1.38355.爆発範囲2.1~13.5体積%.水,エタノール,エーテルに易溶.塗料,印刷インキなどの溶剤として用いられる.森北出版「化学辞典(第2版)

用途溶剤、有機合成原料

用途HPLC分析における溶離液及びその調製。

用途溶剤(インキ、塗料、化粧品、殺虫剤)、プロピル基導入化学品(自動車補修用塗料、ハイソリッド塗料システム)

説明1-propanol is the compound with the hydrogen atom in the propane molecules being replaced by hydroxyl group. Because the hydroxyl group can substitute the hydrogen atoms contained in the carbons in the two terminals of carbon chain or middle carbon, thus generating two isomers, n-propyl alcohol and isopropyl alcohol.The chemical property of the 1-propanol is similar to that of ethanol. It is the byproduct during the process of the methanol synthesis from carbon monoxide and hydrogen. At room temperature and normal pressure, it appears as colorless transparent liquid with fragrance odor. In industry, it is prepared through the reaction between ethylene, carbon monoxide and hydrogen under high pressure and cobalt catalysis; alternatively through the hydration of propylene under the action of sulfate or through the catalytic hydrogenation of acetone. It is commonly used as a solvent with irritating effect on the eyes and mucosa. Inhalation of propyl alcohol steam can lead to dizziness, headache and vomiting, etc.

天然物の起源Reported found in the natural aromas of apple, cognac and rum; also formed during alcoholic fermentation. Also reported found in apple, apricot, banana, sweet cherry, papaya, pineapple, orange juice, lingonberry, cranberry, grapes, peas, pineapple, raspberry, strawberry, onion, leek, tomato, ginger, vinegar, many cheeses, butter, fatty fish, fish oil, cooked beef, mutton and pork, beer, several types of bread, pear brandy, Scotch blended whiskey, malt whiskey, cognac, armagnac, weinbrand rum, bourbon whiskey, Irish whiskey, rum, grape wines, cider, sherry, cocoa, tea, roasted filberts and peanuts, honey, soybean, oats, passion fruit, plum, beans, mushroom, apple and plum brandy, gin, rice, rice bran, quince, prickly pear, jackfruit, sake, buckwheat, loquat, wild rice, anise brandy, endive, truffle, arrack, clam, cape gooseberry and Chinese quince.

使用1-Propanol is used in making n-propyl acetate; and as a solvent for waxes, resins, vegetable oils, and flexographic printing ink. It is produced from the fermentation and spoilage of vegetable matter.

一般的な説明N-propanol appears as a clear colorless liquid with a sharp musty odor like rubbing alcohol. Flash point 53-77 °F. Autoignites at 700 °F. Vapors are heavier than air and mildly irritate the eyes, nose, and throat. Density approximately 6.5 lb / gal. Used in making cosmetics, skin and hair preparations, pharmaceuticals, perfumes, lacquer formulations, dye solutions, antifreezes, rubbing alcohols, soaps, window cleaners, acetone and other chemicals and products.

調製方法 · 2 件

製造方法1-Propanol is produced commercially by the oxo process by reacting ethylene with carbon monoxide and hydrogen in the presence of a catalyst to give propionaldehyde, which is then hydrogenated. 1-Propanol [71-23-8] is the major product of catalytic reduction of propanal (→Propanols). Reduction is carried out most economically by a continuous vapor-phase process over a heterogeneous catalyst of supported reduced nickel, copper, and/or zinc and manganese metals.

合成方法微生物による生合成経路を大腸菌に導入

上流・下流製品情報

上流原料

アクロレイン (モノマー)プロピオンアルデヒドフ-ゼル油アリルアルコール亜硝酸プロピルジイソプロピルアミンN,N-ジイソプロピルニトロソアミン2-エチル-4-メチル-1,3-ジオキソランPropionic-2,3-14C1 acid (8CI)ヒドロキシアセトン2,3-プロパンジオール

下流製品

4-ヒドロキシ安息香酸プロピル8-メチル-8-アザビシクロ[3.2.1]オクタン-3-アミン二塩酸塩N-メチル-1,2-フェニレンジアミン二塩酸塩N-フェニルカルバミド酸プロピル4-(Propylthio)benzene-1,2-diamineエリスロマイシンジクロロ(1,5-シクロオクタジエン)白金(II)1-ブロモプロパンプロピルアミンn-酪酸 n-プロピルプロパン3,3'-ジアミノジプロピルアミン
補足説明 · 2 件

定義本品は、次の化学式で表される脂肪族アルコールである。

定義ChEBI: 1-Propanol is the parent member of the class of propan-1-ols that is propane in which a hydrogen of one of the methyl groups is replaced by a hydroxy group. It has a role as a protic solvent and a metabolite. It is a short-chain primary fatty alcohol and a member of propan-1-ols.