Hexane

HCID 8058CAS 110-54-3

기본 정보

표준 SMILES
CCCCCC
InChIKey
VLKZOEOYAKHREP-UHFFFAOYSA-N
분자식
C6H14
평균 분자량
86.18 g/mol
단동위원소 질량
86.10955045

이름 및 식별자

우선 이름
Hexane
IUPAC
hexane
현지명
노르말헥산
영어명
Hexane
분자식
C6H14
분자량
86.18

이름 및 동의어

HEXANEn-Hexane110-54-3Skellysolve BEsaniGettysolve-BHexyl hydrideDipropylHexanenHeksannormal-hexaneDTXSID0021917
이름 더 보기
헥산노르말헥산노말헥세인메틸(2-)펜탄헥산95%헥산98%헥산99%헥산(HEXANE)N-헥산헥산헥실수소화물노말헥산N-헥세인노멀 헥세인HEXANES1-HEXANEOXFORDn-Hexann-Hexane, HPLC, 95.0% min.NAPHTHA SOLVENTISOHEXANES
NCI-C605712DDG612ED8CHEBI:29021NSC-68472DTXCID001917NSC68472RefChem:66581S70G88A39

데이터베이스 식별자

CAS
110-54-3、478799-92-7、92112-69-1
PubChem CID
8058
DTXSID
DTXSID0021917
ChEMBL
CHEMBL15939
ChEBI
CHEBI:29021
UNII
2CE3AJR3M4、2DDG612ED8
EC Number
203-777-6、295-570-2
Nikkaji
J1.977A

물성

구조 계산 물성

XLogP
3.9
극성 표면적
0 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
0
회전 가능 결합 수
3
무거운 원자 수
6

실험 및 물리화학적 성질

LogP · 3건

log Kow = 3.90

3.90

3.9

OdorGasoline-like odor
Density · 6건

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

0.6606 g/cu cm at 25 °C

Relative density (water = 1): 0.7

0.66

0.6606 @25 °C

0.66

Viscosity · 3건

0.377 cP at 15 °C

3.26X10-4 Pa-s at 20 °C

1.4 mm²/s

Color/Form · 2건

Liquid

Colorless, very volatile liquid

Solubility · 6건

less than 1 mg/mL at 61.7 °F (NTP, 1992)

In water, 9.5 mg/L at 25 °C

9.5 to 13 mg/L at 20 °C in distilled water, 75.5 mg/L at 20 °C in salt water

Very soluble in ethanol; soluble in ethyl ether, chloroform

Miscible with alcohol, chloroform, and ether

0.0095 mg/mL at 25 °C

물리화학적 성질

녹는점
-95 °C · -95 °C
끓는 점
68.95 °C · 68.95 °C(lit.)
밀도
0.659 g/mL · 0.659 g/mL at 25 °C(lit.)
증기 밀도
3.5 · 3.5 (vs air)
증기압
40 mm · 40 mm Hg ( 20 °C)
굴절률
20 · n20/D 1.388
화학적 성질 · 1건

n-Hexane is a highly flammable liquid, usually isolated from crude oil, and has extensive industrial applications as a solvent in adhesive bandage factories and other industries. It is highly toxic, triggering several adverse health effects, i.e., nausea, skin irritation, dizziness, numbness of limbs, CNS depression, vertigo, and respiratory tract irritation to animals and humans. Occupational exposure of industrial workers has demonstrated motor polyneuropathy. Workers associated with long-term glue sniffi ng showed adverse effects in the form of degeneration of axons and nerve terminals.

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H225: Highly Flammable liquid and vapor [Danger Flammable liquids];H304: May be fatal if swallowed and enters airways [Danger Aspiration hazard];H315: Causes skin irritation [Warning Skin corrosion/irritation];H336: May cause drowsiness or dizziness [Warning Specific target organ toxicity, single exposure; Narcotic effects];H361f ***: Suspected of damaging fertility [Warning Reproductive toxicity];H372: Causes damage to organs through prolonged or repeated exposure [Danger Specific target organ toxicity, repeated exposure];H411: Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P203, P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, P273, P280, P301+P316, P302+P352, P303+P361+P353, P304+P340, P318, P319, P321, P331, P332+P317, P362+P364, P370+P378, P391, 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% (2 of 4001) of reports.

유해성 정보

Regulatory Information · 6건

Chemical: Hexane

Chemical: Hexane, branched and linear

Hazard Traits - Environmental tox; Neurotoxicity; Reproductive Toxicity;Authoritative List - ATSDR Neurotoxicants; CA TACs; CWA 303(d); IRIS Neurotoxicants; OEHHA RELs; Prop 65;Report - regardless of intended function of ingredient in the product

Regulation (EC) No 178/2002 (amended)

Hexane is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Hexane 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)

Status: Active Update: 03-11-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/15741

Other Safety InformationIMAP assessments - n-Hexane: Human health tier II assessment
DOT LabelFlammable Liquid
Fire Hazards · 3건

Behavior in Fire: Vapors may explode (USCG, 1999)

· HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames.;· Vapors may form explosive mixtures with air.;· Vapors may travel to source of ignition and flash back.;· Most vapors are heavier than air. They will spread along the ground and collect in low or confined areas (sewers, basements, tanks, etc.).;· Vapor explosion hazard indoors, outdoors or in sewers.;· Those substances designated with a (P) may polymerize explosively when heated or involved in a fire.;· Runoff to sewer may create fire or explosion hazard.;· Containers may explode when heated.;· Many liquids will float on water.;· Substance may be transported hot.;· For hybrid vehicles, GUIDE 147 (lithium ion or sodium ion batteries) or GUIDE 138 (sodium batteries) should also be consulted.;· If molten aluminum is involved, refer to GUIDE 169.

Highly flammable. Vapour/air mixtures are explosive.

Fire Potential · 3건

Flammable. Flashback along vapor trail may occur.

Flammable liquid. A very dangerous fire and explosion hazard when exposed to heat or flame...

Flammable, dangerous fire risk.

Health Hazards · 2건

INHALATION causes irritation of respiratory tract, cough, mild depression, cardiac arrhythmias. ASPIRATION causes severe lung irritation, coughing, pulmonary edema; excitement followed by depression. INGESTION causes nausea, vomiting, swelling of abdomen, headache, depression. (USCG, 1999)

CAUTION: Petroleum crude oil (UN1267) may contain TOXIC hydrogen sulphide gas.;· Inhalation or contact with material may irritate or burn skin and eyes.;· Fire may produce irritating, corrosive and/or toxic gases.;· Vapors may cause dizziness or asphyxiation, especially when in closed or confined areas.;· Runoff from fire control or dilution water may cause environmental contamination.

안전 및 보호

Fire Fighting · 2건

Excerpt from ERG Guide 128 [Flammable Liquids (Water-Immiscible)]:;CAUTION: The majority of these products have a very low flash point. Use of water spray when fighting fire may be inefficient. CAUTION: For mixtures containing alcohol or polar solvent, alcohol-resistant foam may be more effective.;SMALL FIRE: Dry chemical, CO2, water spray or regular foam. If regular foam is ineffective or unavailable, use alcohol-resistant foam.;LARGE FIRE: Water spray, fog or regular foam. If regular foam is ineffective or unavailable, use alcohol-resistant foam. Avoid aiming straight or solid streams directly onto the product. If it can be done safely, move undamaged containers away from the area around the fire.;FIRE INVOLVING TANKS, RAIL TANK CARS OR HIGHWAY TANKS: Fight fire from maximum distance or use unmanned master stream devices or monitor nozzles. Cool containers with flooding quantities of water until well after fire is out. For petroleum crude oil, do not spray water directly into a breached tank car. This can lead to a dangerous boil over. Withdraw immediately in case of rising sound from venting safety devices or discoloration of tank. ALWAYS stay away from tanks in direct contact with flames. For massive fire, use unmanned master stream devices or monitor nozzles; if this is impossible, withdraw from area and let fire burn. (ERG, 2024)

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

First Aid Measures · 4건

Fresh air, rest. Refer for medical attention.

Remove contaminated clothes. Rinse and then wash skin with water and soap. Refer for medical attention .

First rinse with plenty of water for several minutes (remove contact lenses if easily possible), then refer for medical attention.

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

Accidental Release Measures · 2건

· 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.;· Keep unauthorized personnel away.;· Stay upwind, uphill and/or upstream.;· Ventilate closed spaces before entering, but only if properly trained and equipped.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.;· All equipment used when handling the product must be grounded.;· Do not touch or walk through spilled material.;· Stop leak if you can do it without risk.;· Prevent entry into waterways, sewers, basements or confined areas.;· A vapor-suppressing foam may be used to reduce vapors.;· Absorb or cover with dry earth, sand or other non-combustible material and transfer to containers.;· Use clean, non-sparking tools to collect absorbed material.;Large Spill;· Dike far ahead of liquid spill for later disposal.;· Water spray may reduce vapor, but may not prevent ignition in closed spaces.

First Aid · 3건

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.;SKIN: IMMEDIATELY flood affected skin with water while removing and isolating all contaminated clothing. Gently wash all affected skin areas thoroughly with soap and water. If symptoms such as redness or irritation develop, IMMEDIATELY call a physician and be prepared to transport the victim to a hospital for treatment.;INHALATION: IMMEDIATELY leave the contaminated area; take deep breaths of fresh air. If symptoms (such as wheezing, coughing, shortness of breath, or burning in the mouth, throat, or chest) develop, call a physician and be prepared to transport the victim to a hospital. Provide proper respiratory protection to rescuers entering an unknown atmosphere. Whenever possible, Self-Contained Breathing Apparatus (SCBA) should be used; if not available, use a level of protection greater than or equal to that advised under Protective Clothing.;INGESTION: DO NOT INDUCE VOMITING. Volatile chemicals have a high risk of being aspirated into the victim's lungs during vomiting which increases the medical problems. If the victim is conscious and not convulsing, give 1 or 2 glasses of water to dilute the chemical and IMMEDIATELY call a hospital or poison control center. IMMEDIATELY transport the victim to a hospital. If the victim is convulsing or unconscious, do not give anything by mouth, ensure that the victim's airway is open and lay the victim on his/her side with the head lower than the body. DO NOT INDUCE VOMITING. IMMEDIATELY transport the victim to a hospital. (NTP, 1992)

General First Aid:;· Call 911 or emergency medical service.;· Ensure that medical personnel are aware of the material(s) involved, take precautions to protect themselves and avoid contamination.;· Move victim to fresh air if it can be done safely.;· Administer oxygen if breathing is difficult.;· If victim is not breathing:;-- DO NOT perform mouth-to-mouth resuscitation; the victim may have ingested or inhaled the substance.;-- If equipped and pulse detected, wash face and mouth, then give artificial respiration using a proper respiratory medical device (bag-valve mask, pocket mask equipped with a one-way valve or other device).;-- If no pulse detected or no respiratory medical device available, provide continuous compressions. Conduct a pulse check every two minutes or monitor for any signs of spontaneous respirations.;· Remove and isolate contaminated clothing and shoes.;· For minor skin contact, avoid spreading material on unaffected skin.;· In case of contact with substance, remove immediately by flushing skin or eyes with running water for at least 20 minutes.;· For severe burns, immediate medical attention is required.;· Effects of exposure (inhalation, ingestion, or skin contact) to substance may be delayed.;· Keep victim calm and warm.;· Keep victim under observation.;· For further assistance, contact your local Poison Control Center.;· Note: Basic Life Support (BLS) and Advanced Life Support (ALS) should be done by trained professionals.;Specific First Aid:;· Wash skin with soap and water.

(General first aid procedures);Eye: Irrigate immediately - If this chemical contacts the eyes, immediately wash (irrigate) the eyes with large amounts of water, occasionally lifting the lower and upper lids. Get medical attention immediately.;Skin: Soap wash immediately - If this chemical contacts the skin, immediately wash the contaminated skin with soap and water. If this chemical penetrates the clothing, immediately remove the clothing, wash the skin with soap and water, and get medical attention promptly.;Breathing: Respiratory support;Swallow: Medical attention immediately - If this chemical has been swallowed, get medical attention immediately.

Safe StorageStore only in original container. Fireproof. Separated from strong oxidants. Well closed. Ventilation along the floor. Provision to contain effluent from fire extinguishing. Store in an area without drain or sewer access.
Exposure Control and Personal Protection · 3건

· Wear positive pressure self-contained breathing apparatus (SCBA).;· Structural firefighters' protective clothing provides thermal protection but only limited chemical protection.

Biological Exposure Indices (BEI) [ACGIH] - 2,5-Hexanedione (without hydrolysis) in urine = 0.5 mg/L end of shift;

50.0 [ppm]

독성 정보

Toxicological InformationCDC-ATSDR Toxicological Profile
Body Burden · 1건

n-Hexane was detected in 8 of 12 samples of mothers breast milk from the cities of Bayonne NJ, Jersey City NJ, Bridgeville PA and Baton Rouge LA(1). The air expired from humans contained n-hexane in 6.9% of the 387 samples collected from 54 subjects(2). The average n-hexane concentration of 4.7 ng/L was expressed as the geometric mean with upper and lower limits of 13.5 and 1.63 ng/L, respectively(2).

Interactions · 5건

To study the protective effects of garlic oil (GO) on the peripheral nerve injuries induced by n-hexane. Male Wistar rats were randomly divided into four groups (10 rats in each group): the control, the n-hexane treatment (2000 mg/kg), the low dose GO, and the high dose GO groups. The rats in the low and high doses of GO groups were pretreated with GO (40 and 80 mg/kg) before exposure to n-hexane (2000 mg/ kg), while the animals of the n-hexane treatment group were given normal saline and then 2000 mg/ kg n-hexane. The rats were exposed to GO and n-hexane 6 times a week for 10 weeks. The gait scores and staying time on the rotating rod for all rats were detected every two weeks. The rats were sacrificed at the end of ten weeks, then the levels of alcohol dehydrogenase (ADH), maleic dialdehyde (MDA), reduced glutathione (GSH), glutathione peroxidase (GSH-Px), total antioxidation capacity (T-AOC) and the ability of inhibition of OH in livers were examined. The gait scores increased significantly and the time staying on the rotating rod obviously decreased in rats of n-hexane treatment group, as compared with control group (P < 0.05 or P < 0.01). In the hepatic tissues of n-hexane group, the levels of MDA and ADH significantly increased, the activities of GSH-Px, T-AOC and the ability of inhibition of OH obviously decreased, as compared to control group (P < 0.05 or P < 0.01). In 2 GO groups, the gait scores and the staying time on the rotating rod were significantly improved, the levels of MDA and ADH significantly decreased, the activities of GSH-Px, T-AOC and the ability of inhibition of OH obviously increased, as compared with n-hexane group (P < 0.05 or P < 0.01). ADH could play an important role in the protective effects induced by garlic oil on the peripheral nerve injuries produced by n-hexane.

Four separate groups of 5 rats each were exposed to 1000 ppm n-hexane, 1000 ppm n-hexane plus 1000 ppm toluene, 1000 ppm n-hexane plus 1000 ppm methyl ethyl ketone (MEK), or fresh air. Distributions of n-hexane metabolites in the mixed exposure group were ... similar to that of an n-hexane-alone group. The amount of metabolites decreased to approximately 1/6 of that in the n-hexane group by co-exposure with toluene and to approximately 1/4 by co-exposure with MEK. Toluene decr the neurotoxicity of n-hexane by the inhibition of n-hexane metabolism.

Toluene at 1000 ppm exerted an antagonistic effect on n-hexane neurotoxicity in rats exposed to 1000 ppm n-hexane 12 hr/day for 16 wk. While 1000 ppm n-hexane considerably impaired the function of peripheral nerves, as measured by nerve conduction velocities in the rat tail, the combined exposure resulted in only slight impairment.

n-Hexane ... potentiates chloroform toxicity.

For more Interactions (Complete) data for N-HEXANE (6 total), please visit the HSDB record page.

Target Organs · 3건

Neurological (Nervous System), Respiratory (From the Nose to the Lungs)

Nervous

Eyes, skin, respiratory system, central nervous system, peripheral nervous system

Health Effects · 1건

Hexane mainly affects the nervous system. It causes degeneration of the peripheral nervous system (and eventually the central nervous system), starting with damage to the nerve axons. Exposure to hexane may also damage the lungs and reproductive system. (L977, L978)

Ecotoxicity Values · 5건

LC50; Species: Goldfish; Concentration: 4 mg/L for 24 hr /Conditions of bioassay not specified/

EC50; Species: Chlamydomonas angulosa (Green Algae) age 3-4 days, exponential growth phase 5x10+4 cells/mL; Conditions: static, 19 °C, pH 6.5; Concentration: 94 mmol/cu m for 3 hr; Effect: physiology, photosynthesis /formulation/

EC50; Species: Chlorella vulgaris (Green Algae) age 3-4 days, exponential growth phase 20x10+4 cells/mL; Conditions: static, 19 °C, pH 6.5; Concentration: 149 mmol/cu m for 3 hr; Effect: physiology, photosynthesis /formulation/

LC50; Species: Artemia salina (Brine Shrimp) nauplii; Conditions: saltwater, static, 20 °C; Concentration: 41 mmol/cu m for 24 hr /> or =97% purity formulation/

For more Ecotoxicity Values (Complete) data for N-HEXANE (10 total), please visit the HSDB record page.

규제 정보

Regulatory Information · 6건

Chemical: Hexane

Chemical: Hexane, branched and linear

Hazard Traits - Environmental tox; Neurotoxicity; Reproductive Toxicity;Authoritative List - ATSDR Neurotoxicants; CA TACs; CWA 303(d); IRIS Neurotoxicants; OEHHA RELs; Prop 65;Report - regardless of intended function of ingredient in the product

Regulation (EC) No 178/2002 (amended)

Hexane is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Hexane 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)

Status: Active Update: 03-11-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/15741

FDA RequirementsHexane is an indirect food additive for use only as a component of adhesives.
Atmospheric Standards · 1건

Listed as a hazardous air pollutant (HAP) generally known or suspected to cause serious health problems. The Clean Air Act, as amended in 1990, directs EPA to set standards requiring major sources to sharply reduce routine emissions of toxic pollutants. EPA is required to establish and phase in specific performance based standards for all air emission sources that emit one or more of the listed pollutants. Hexane is included on this list.

CERCLA Reportable Quantities · 1건

Persons in charge of vessels or facilities are required to notify the National Response Center (NRC) immediately, when there is a release of this designated hazardous substance, in an amount equal to or greater than its reportable quantity of 5000 lb or 2270 kg. The toll free number of the NRC is (800) 424-8802. The rule for determining when notification is required is stated in 40 CFR 302.4 (section IV.D.3.b).

State Drinking Water Standards(NJ) NEW JERSEY 30 ug/L
State Drinking Water Guidelines · 5건

(AZ) ARIZONA 4000 ug/L

(FL) FLORIDA 10 ug/L

(ME) MAINE 420 ug/L

(MN) MINNESOTA 400 ug/L

For more State Drinking Water Guidelines (Complete) data for N-HEXANE (6 total), please visit the HSDB record page.

안전 데이터

OEB
A
OEL
TWA: 50 ppm (180 mg/m3)
wgk
3
IDLA
1,100 ppm [10% LEL]
tsca
TSCA listed
rtecs
MN9275000

화학 및 산업

약리 정보

Mechanism of Action · 3건

N-hexane ... causes peripheral polyneuropathy and testicular atrophy. The testicular toxicity is separate from its neurotoxicity. /The metabolite, 2,5-hexanedione (HD)/ produces gonadal toxicity by altering testicular tubulin. The HD testicular toxicity results from alterations in Sertoli cell microtubules and the altered microtubules result from pyrole-dependent cross-linking. HD toxicity is slow in onset. Initially, HD affects the cross-linking of cytoskeletal elements leading to altered protein secretions and trafficking in the Sertoli cell. Consequently, there is altered Sertoli cell-germ cell contacts and a loss of Sertoli cell paracrine support of the germ cells.

2,5-Hexanedione is the toxic metabolite resulting from oxidation of /n-hexane./ ... Exposure to 2,5-hexanedione or its precursors results in a slowly progressive peripheral polyneuropathy and testicular injury. The chemical basis of the injury involves reaction of 2,5-hexanedione with protein amines, such as the epsilon-amine of lysine, to form pyrroles which further react to form protein-protein crosslinks. The target cell of injury in the testis is the supportive cell in the seminiferous epithelium, the Sertoli cell. A major function of the Sertoli cell is to nurture the dependent germ cell population by secreting seminiferous tubule fluid. 2,5-Hexanedione-induced crosslinking of the microtubule subunit protein, tubulin, leads to altered Sertoli cell microtubule-dependent transport and deficient formation of seminiferous tubule fluid, compromising germ cell viability.

n-Hexane's metabolism to 2,5-hexanedione decreases phosphorylation of neurofilaments, which destroys the normal cytoskeletal matrix. Neurofilament proteins are then transported down the axon where they accumulate, crosslink, and produce the giant axonal swelling that characterizes this axonopathy.

Biological Half-LifeUrine (2,5-hexanedione): 15 hours; blood: 2-3 hours; fat: 64 hours; [TDR, p. 769]
Metabolism/Metabolites · 6건

Different levels of physical activity, namely, rest, 25 W, and 50 W (for 12 hr followed by 12 hr at rest) were simulated to assess the impact of work load on the recommended biological exposure indices: ...free (nonhydrolyzed) 2,5-hexanedione (a metabolite of n-hexane) at the end of the shift at the end of the workweek. ... Urinary 2,5-hexanedione predicted for 50 ppm was 1.07 mg/L at 50 W and 0.92 mg/L at rest (+16%). ...

Phenobarbital pre-treatment induces 2- and 3-hydroxylation /of n-hexane/ six-fold; 3,4-benzopyrene suppresses 2- and stimulates 3-hydroxylation.

The major urinary metabolite in rat is 1-hexanol.

...2,5-Hexanedione is principal metabolite of this and other 6-carbon compounds... .

For more Metabolism/Metabolites (Complete) data for N-HEXANE (8 total), please visit the HSDB record page.

Hexane has known human metabolites that include Hexanol.

Absorption, Distribution and Excretion · 5건

Hexane is absorbed through the lungs and relatively poorly absorbed through the intact skin.

Accumulation in the tissues depends on lipid content in these tissues. n-/Hexane/ is oxidized in the liver. Excretion occurs via the lungs and kidneys. ... Excretion of /hexane/ is related to dose.

The pharmacokinetics of inhaled n-hexane in rat and man were compared. In the rat metabolism was saturable. Up to 300 ppm, the metabolic rate was directly proportional to the concentration in the atmosphere, reaching 47 umol/(hr X kg). Only 17% of n-hexane was exhaled unchanged. Above 300 ppm, the amount of n-hexane in the body rose with increasing atmospheric concentrations from 1.6 up to a limiting value of 9.6, which corresponded to the thermodynamic distribution coefficient of n-hexane between the organism and the atmosphere. Up to 3000 ppm, the rate of metabolism increased to 245 umol/(hr X kg); only a slow further increase was found up to 7000 ppm (285 umol/(hr X kg). In man the steady-state concentrations of n-hexane were about 1 ppm. The metabolic clearance was 132 1/hr, and n-hexane accumulated to a factor of 2.3 in the organism. The thermodynamic distribution coefficient was calculated to be 12. Twenty per cent of n-hexane in the body was exhaled unchanged. At low concentrations the rate of metabolism of n-hexane is limited in both species by transport to the enzyme system. Under these conditions the rate of metabolism of n-hexane should not be influenced by xenobiotics which induce the n-hexane metabolizing enzyme system.

... Male Fischer 344 rats were exposed to 500, 1000, 3000 or 10,000 ppm (14)C-n-hexane for 6 hr and the elimination of radioactivity followed for 72 hr after exposure. The disposition of radioactivity was dose-dependent, with 12, 24, 38 and 62% of the acquired body burden excreted as n-hexane by the lung with increasing exposure concentration. In contrast, 38, 31, 27 and 18% of the body burden of radioactivity was recovered as expired (14)CO2 and 35, 40, 31 and 18% was recovered in the urine with increasing n-hexane concentration. Radioactivity remaining in the tissues and carcass 72 hr after exposure represented 6.1, 8.8, 7.4 and 5.4% of the body burden for the respective exposures. The dose-dependent elimination of radioactivity was apparently due in part to an inhibition of n-hexane metabolism, reflected by a decrease in total 14CO2 and urinary 14C excretion after 10,000 ppm exposure compared to the 3000 ppm exposure.

For more Absorption, Distribution and Excretion (Complete) data for N-HEXANE (6 total), please visit the HSDB record page.

Cellular LocationsMembrane

용도 및 제조

Uses · 6건

The main use of hexane is as a solvent to extract edible oils from seed and vegetable crops (e.g., soybeans, peanuts, corn). Hexane is also used as a cleaning agent (degreaser) in the printing industry.

Used as a solvent, especially in the adhesive and shoe industries; abused by glue sniffers for its euphoric effects; [LaDou, p. 430] Used in shoe and furniture manufacture to dissolve glue; also used in adhesive tape manufacturing; [Sullivan, p. 1211] Fuels made from petroleum contain n-hexane. Modern blends of US gasoline contain about 3% n-hexane. [ATSDR ToxProfiles] Used as a solvent for vegetable oils, polymers, and paints; [Hawley] Used as a degreaser by vehicle repair technicians in a commercially available aerosol containing toluene, acetone, and hexane (50% n-hexane); [Reference #2] Used for determining refractive index of minerals, filling for thermometers (instead of mercury), for calibrations, as reaction medium for polymerizations and pharmaceutical manufacture, alcohol denaturant, as cleaning agent in textile, furniture, and leather industries, and as laboratory reagent; [HSDB]

Textiles (Fiber & Fabric Manufacturing) [Category: Industry];Painting (Solvents) [Category: Paint];Working with Glues and Adhesives [Category: Other];Leather Tanning and Processing [Category: Industry]

Leather crafting [Category: Hobbies];Painting [Category: Hobbies];Sculpturing plastics [Category: Hobbies]

Determining refractive index of minerals; filling for thermometers instead of mercury, usually with a blue or red dye; extraction solvent for oilseed processing.

Solvent, especially for vegetable oils; low temperature thermometers; calibrations; polymerization reaction medium; paint diluent; alcohol denaturant.

ImpuritiesThe isomers most commonly accompanying it are 2-methylpentane, 3-methylpentane, 2,3-dimethylbutane and 2,2-dimethylbutane.
U.S. Exports(1972) NEGLIGIBLE
U.S. Imports(1972) NEGLIGIBLE
U.S. Production · 4건

2023: 1,000,000,000 - <2,500,000,000 lb;2022: 1,000,000,000 - <2,500,000,000 lb;2021: 1,000,000,000 - <2,500,000,000 lb;2020: 1,000,000,000 - <2,500,000,000 lb

Hexane is listed as a High Production Volume (HPV) chemical (65FR81686). Chemicals listed as HPV were produced in or imported into the U.S. in >1 million pounds in 1990 and/or 1994. The HPV list is based on the 1990 Inventory Update Rule. (IUR) (40 CFR part 710 subpart B; 51FR21438).

Production volumes for non-confidential chemicals reported under the Inventory Update Rule.[Table#268]

Production volume for non-confidential chemicals reported under the 2006 Inventory Update Rule. Chemical: Hexane. Aggregated National Production Volume: 500 million to < 1 billion pounds.

Consumer UsesIntermediate;Propellants, non-motive (blowing agents);Laboratory chemicals;Not Known or Reasonably Ascertainable;Monomers;Fuel;Fuel agents;Solvent;Flavoring and nutrient;Lubricating agent
응용 분야 · 3건

용도1.유기 합성; 2.입니다. 용 매가 식물 기름 추출; 3.추출 에이전트, 화학 시 약.

용도n-Hexane is a chief constituent of petroleumether, gasoline, and rubber solvent. It is usedas a solvent for adhesives, vegetable oils,and in organic analysis, and for denaturingalcohol.

일반 설명Clear colorless liquids with a petroleum-like odor. Flash points -9°F. Less dense than water and insoluble in water. Vapors heavier than air. Used as a solvent, paint thinner, and chemical reaction medium.

상·하류 제품 정보

하류 제품

RAPESEEDOIL,SUPERGLYCERINATED,FULLYHYDROGENATED2-(2-이소프로필페닐)-4,4,5,5-테트라메틸-1,3,2-디옥사보롤란Mono-caprylin glycerate1-메틸-2-이미다졸카르복스알데히드Maize yellIow2-(4-chlorop henyl)-4,5-dihydro-1-methyl-5-(trifluoromethyl)-1H-pyr role-3-carbonitrile(1R,3S)-3-Aminocyclopentanecarboxylic acid1,1′-페로센다이카르복스알데하이드CANOLA OIL1 1'-BIS(DIPHENYLPHOSPHINO)FERROCENE(2,2-디메틸-프로필)-하이드라진N-메틸-o-톨루이딘

공급사24 곳

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추가 설명 · 3건

순도시험(1) 비중 : 이 품목의 비중은 0.665~0.687이어야 한다. (2) 굴절률 : 이 품목의 굴절률 은 1.374~1.386이어야 한다. (3) 황화합물 : 이 품목 5mL에 질산은암모니아시액 5mL를 가하여 잘 흔들어 섞으면서 광선을 피하여 60℃에서 5분간 가열할 때, 갈색을 나타내어서는 아니 된다. (4) 황산정색물 : 이 품목 5mL를 네슬러관에 취하여 94.5~95.5% 황산 5mL를 가하여 5분간 심하게 진탕 혼합할 때, 황산층의 색은 비색표준용액 B보다 진하여서는 아니 된다. (5) 벤젠 : 이 품목 50mL를 취해 여기에 내부표준물질용액 50mL를 가해서 혼합하고 이것을 시험용액으로 한다. 따로 벤젠표준용액 50mL를 취하여 내부표준물질용액 50mL를 가하여 혼합하고 이것을 표준용액으로 한다. 시험용액 및 표준용액을 다음의 조건에서 가스크로마토그래피를 행할 때, 시험용액의 표시피크높이(H)와 내부표준물질의 표시피크높이(Hs)와의 비 H/Hs는 표준용액의 표시피크높이(H'')와 내부표준물질의 표시피크높이(Hs'')와의 비 H''/Hs'' 보다 크지 않아야 한다. 다만, 내부표준물질용액은 메틸이소부틸케톤 0.5mL를 취해 n-헥산(자외부흡수스펙트럼측정용)을 가해서 100mL로 한 것을, 벤젠표준용액은 벤젠 0.05mL를 취해 n-헥산(자외부흡수스펙트럼측정용)을 가해서 100mL로 한 것을 사용한다. 조작조건 칼 럼 : 내경 3~4mm, 길이 2~3m의 스텐레스관 또는 유리관 칼럼충전제 : 177~250μm 가스크로마토그래피용 담체에 대해서 10%되는 양의 폴리에틸렌글리콜 6,000을 함유하는 클로로포름용액을 가해 클로로포름을 증발하고 건조한 것 칼럼온도 : 50~70℃의 일정온도 검 출 기 : 수소염이온화검출기(FID) 캐리어가스 및 유량 : 질소가스를 이용한다. 벤젠이 약 5분에 나오도록 캐리어가스의 유량을 조정한다. (6) 증류시험 : 이 품목은 비점 및 유분측정법중 제2법에 따라 유분을 측정할 때, 64~70℃에서 95% 이상을 유출하여야 한다. (7) 증발잔류물 : 이 품목 150mL를 주의하면서 수욕상에서 가열하여 증발한 다음 105℃에서 30분간 건조할 때, 그 잔류물은 2mg 이하이어야 한다. (8) 납 : 이 품목 5.0g을 취하여 원자흡광광도법 또는 유도결합플라즈마발광광도법에 따라 시험할 때, 그 양은 1.0ppm 이하이어야 한다. (9) 다환방향족탄화수소 : 이 품목 25mL를 취하여 125mL 분액깔대기에 옮기고 n-헥산 25mL를 가하여 잘 흔들어 섞은 다음 디메틸설폭시드 5mL를 가하여 1분간 세게 흔들어 섞고 층이 분리될 때까지 정치한다. 하층을 분액깔대기에 옮기고 n-헥산 2mL를 가하여 2분간 세게 흔들어 섞은 후 층이 분리될 때까지 정치한 다음 하층을 취하여 시험용액으로 한다. 디메틸설폭시드 5mL 및 헥산 25mL를 각각 취하여 1분간 흔들어 섞고 정치한 후 얻어진 하층을 공시험용액으로 하여 파장 260~420nm에서 시험용액의 흡광도를 측정한다. 따로, 대조액으로 나프탈렌 7.0mg을 정밀히 달아 이소옥탄 1,000mL에 녹인 액을 이소옥탄을 공시험용액으로 하여 파장 275nm에서 대조액의 흡광도를 측정한다. 파장 260~420nm에서 시험용액의 흡광도를 측정할 때, 그 값은 파장 275nm에서 측정한 대조액의 흡광도 값의 1/3을 초과하여서는 아니 된다.

정의이 품목은 석유 성분중에서 n-헥산의 비점부근에서 증류하여 얻어진 것이다.

정의ChEBI: An unbranched alkane containing six carbon atoms.

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