1,1-Dimethylcyclohexane

HCID 11549CAS 27195-67-1

部分構造検索類似構造を探す

基本情報

標準SMILES: CC1(C)CCCCC1
InChIKey: QEGNUYASOUJEHD-UHFFFAOYSA-N
分子式: C8H16
平均分子量: 112.21 g/mol
単同位体質量: 112.12520051

概要

1,1-dimethyl-Cyclohexane is a cycloalkane.

名称と識別子

優先名称: 1,1-Dimethylcyclohexane
IUPAC: 1,1-dimethylcyclohexane
英語名: 11,1-Dimethylcyclohexane
分子式: C8H16
分子量: 112.21

名称と別名

1,1-Dimethylcyclohexane590-66-9gem-DimethylcyclohexaneCyclohexane, 1,1-dimethyl-2MEV4299RCNSC-74156DTXSID1074832RefChem:1051793DTXCID2042517209-687-31,1-dimethyl-cyclohexane27195-67-1

名称をさらに表示

EINECS 209-687-3NSC 74156UNII-2MEV4299RCAI3-28793Cyclohexane, dimethyl-DIMETHYLCYCLOHEXANE1,1-DIMETHYL CYCLOHEXANEDimethylcyclohexanes

データベース識別子

CAS: 27195-67-1、590-66-9
PubChem CID: 11549
DTXSID: DTXSID1074832
ChEBI: CHEBI:229279
UNII: 2MEV4299RC
EC Number: 209-687-3
Nikkaji: J43.468J

物性

構造計算による物性

XLogP: 3.9
極性表面積: 0 Å²
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: 0
重原子数: 8
形式電荷: 0
複雑度: 64.1

実験および物理化学的性質

SolventsSolvents -> Aliphatics, Saturated (<C12)

SpringerMaterials PropertiesSchoenflies notation

Vapor Pressure22.7 [mmHg]

Physical DescriptionClear colorless liquid; [Sigma-Aldrich MSDS]

物理化学的性質

融点: -33.3 °C · -33.3 °C
沸点: 119.6 °C · 119.6 °C
比重(密度): 0.798 g/cm3 · 0.798 g/cm3(Temp: 15 °C)

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 reports by companies from 1 notifications to the ECHA C&L Inventory.

危険有害性情報

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

Health HazardsCAUTION: Petroleum crude oil (UN1267) may contain TOXIC hydrogen sulphide gas.

Hazards SummaryMay cause irritation; [Sigma-Aldrich MSDS] See Cyclohexane.

DOT ID and Guide2263 128

DOT Hazard Classification · 4 件

Dimethylcyclohexanes

UN2263

Class 3 Flammable and combustible liquid (49 eCFR § 173.120)

PG II: the degree of danger presented by the material is medium

Hazard Classes and CategoriesFlam. Liq. 2 (100%)

安全と保護具

Accidental Release Measures · 2 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.

First AidGeneral First Aid:

Exposure Control and Personal Protection· Wear positive pressure self-contained breathing apparatus (SCBA).

Isolation and EvacuationImmediate precautionary measure

Emergency Response Planning GuidelinesCAUTION: The majority of these products have a very low flash point. Use of water spray when fighting fire may be inefficient.

毒性情報

Adverse EffectsNeurotoxin - Acute solvent syndrome

化学と産業

サプライヤー10 社

武汉市恒久化工有限公司17317534732 17671758929 · [email protected]

南通合润生物科技有限公司18362409333 · [email protected]

上海毕楷科技有限公司18516304666

Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]

天津荣燊化工有限公司18317763565; 18317763565 · [email protected]