p-メンタン

1-Methyl-4-isopropylcyclohexane

HCID 7459CAS 1329-99-3

基本情報

標準SMILES
CC1CCC(C(C)C)CC1
InChIKey
CFJYNSNXFXLKNS-UHFFFAOYSA-N
分子式
C10H20
平均分子量
140.27 g/mol
単同位体質量
140.15650064

概要

P-menthane is a clear liquid. (NTP, 1992)

名称と識別子

優先名称
1-Methyl-4-isopropylcyclohexane
IUPAC
1-methyl-4-propan-2-ylcyclohexane
現地名
p-メンタン
英語名
p-Menthane
分子式
C10H20
分子量
140.27

名称と別名

1-methyl-4-isopropylcyclohexaneRefChem:1055810p-Menthane99-82-16069-98-3cis-1-isopropyl-4-methylcyclohexane1678-82-61-ISOPROPYL-4-METHYLCYCLOHEXANEtrans-1-isopropyl-4-methylcyclohexanecis-p-Menthanetrans-p-Menthanep-Menthane, trans-
名称をさらに表示
1-メチル-4-イソプロピルシクロヘキサン1-メチル-4-(1-メチルエチル)シクロヘキサン4-イソプロピル-1-メチルシクロヘキサンヘキサヒドロ-p-シメン1-イソプロピル-4-メチルシクロヘキサンpメンタンp-メンタン1-methyl-4-(1-methylethyl)cyclohexane1-methyl-4-(1-methylethyl)-Cyclohexanepara-menthaneGLIDSOL 180Woody River 10Hexahydro-p-cymeneTIMTEC-BB SBB008406Para-menthane / P-Menthane
p-Menthane, cis-1-iso-Propyl-4-methylcyclohexaneCyclohexane, 1-methyl-4-(1-methylethyl)-, trans-p-Menthan1-methyl-4-propan-2-ylcyclohexaneCyclohexane, 1-methyl-4-(1-methylethyl)-, cis-1-Methyl-trans-4-isopropylcyclohexaneCyclohexane, 1-methyl-4-(1-methylethyl)-

データベース識別子

CAS
1329-99-3、1678-82-6、34448-33-4、6069-98-3、99-82-1
PubChem CID
7459
DTXSID
DTXSID9025530
ChEBI
CHEBI:25826
UNII
CGW5GN8TXU
EC Number
202-790-4、252-034-2、679-820-1、679-821-7、951-486-4、951-489-0
Nikkaji
J124.993B、J130.647B、J3.997G

物性

構造計算による物性

XLogP
4.5
極性表面積
0 Ų
水素結合供与体数
0
水素結合受容体数
0
回転可能結合数
1
重原子数
10

実験および物理化学的性質

LipidsLipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> C10 isoprenoids (monoterpenes) [PR0102]
Solvents · 2 件

Solvents -> Aliphatics, Saturated (<C12)

Solvents -> Aliphatics, Saturated (<C12)

SpringerMaterials PropertiesBoiling point
FragrancesFragrance Ingredient (Cyclohexane, 1-_methyl-_4-_(1-_methylethyl)_-) -> IFRA transparency List
LogP5.56
Density0.8039 AT 20 °C/4 °C

物理化学的性質

融点
-87.6 ℃ · -87.6℃
沸点
171 · 171.0-171.7℃
比重(密度)
0.797 · 0.7970
蒸気圧
3.52 hPa · 3.52hPa at 25℃
屈折率
1.45562 · 1.45562 (589.3 nm 22℃)
貯蔵温度
Store at room temperature
化学的性質 · 1 件

化学的特性p-Menthane is a colorless liquid with a fragrant fennel-like odor. It occurs naturally, especially in exudates of Eucalyptus fruits. The compound is generally encountered as a mixture of the cis and trans isomers, which have very similar properties.

安全と法規制

GHS分類

GHS Classification · 6 件

Danger

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P264, P280, P301+P316, P302+P352, P303+P361+P353, P321, P331, P332+P317, P362+P364, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 269 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

危険有害性情報

Regulatory Information · 3 件

Chemical: Cyclohexane, 1-methyl-4-(1-methylethyl)-

Cyclohexane, 1-methyl-4-(1-methylethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Cyclohexane, 1-methyl-4-(1-methylethyl)- 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: 12-05-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/12773

Fire HazardsFlash point data for this chemical are not available, however it is probably combustible. (NTP, 1992)
Hazards Summary · 2 件

A mild eye irritant; [MSDSonline] See Methylcyclohexane.

See Cyclohexane.

Reactive GroupHydrocarbons, Aliphatic Saturated
Reactivity Profile · 1 件

Saturated aliphatic hydrocarbons, such as P-MENTHANE, may be incompatible with strong oxidizing agents like nitric acid. Charring of the hydrocarbon may occur followed by ignition of unreacted hydrocarbon and other nearby combustibles. In other settings, aliphatic saturated hydrocarbons are mostly unreactive. They are not affected by aqueous solutions of acids, alkalis, most oxidizing agents, and most reducing agents. When heated sufficiently or when ignited in the presence of air, oxygen or strong oxidizing agents, they burn exothermically to produce carbon dioxide and water.

Air and Water ReactionsFlammable. Insoluble in water.

安全と保護具

Fire FightingFires involving this compound can be controlled using a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1 件

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.

Nonfire Spill Response · 1 件

SMALL SPILLS AND LEAKAGE: If you spill this chemical, use absorbent paper to pick up all liquid spill material. Your contaminated clothing and absorbent paper should be sealed in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with alcohol followed by washing with a strong soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Personal Protective Equipment (PPE) · 1 件

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

毒性情報

Adverse Effects · 2 件

Neurotoxin - Acute solvent syndrome

Neurotoxin - Acute solvent syndrome

安全データ

tsca
TSCA listed
ridadr
3295
risk_code
11
化審法
一般化学物質
safety_code
9-16-26-33
有毒物質データの
99-82-1(Hazardous Substances Data)

化学と産業

薬理情報

Cellular LocationsExtracellular

用途と製造

UsesUsed as a cleaner; [MSDSonline]
U.S. Production2023: 75,000 - <500,000 lb
Industry UsesOdor agents
Use ClassificationFragrance Ingredients
General Manufacturing Information · 4 件

Adhesive Manufacturing

Cyclohexane, 1-methyl-4-(1-methylethyl)-: ACTIVE

Cyclohexane, 1-methyl-4-(1-methylethyl)-, trans-: ACTIVE

Cyclohexane, 1-methyl-4-(1-methylethyl)-, cis-: ACTIVE

応用分野 · 3 件

用途有機合成原料。

用途石鹸、洗剤用香料、芳香剤、洗浄剤等の微香性の溶剤

一般的な説明Clear liquid.

調製方法

合成方法GPPからリモネン合成酵素による生合成

サプライヤー1 社

尤尼威尔化学品(上海)有限公司021-61932772 13012862996 · [email protected]

関連反応

2 件

関連ノート

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