1-Methyl-1,2-epoxycyclohexane

HCID 224243CAS 1713-33-3

基本情報

標準SMILES: CC12CCCCC1O2
InChIKey: FIEKVYPYFQSFTP-UHFFFAOYSA-N
分子式: C7H12O
平均分子量: 112.17 g/mol
単同位体質量: 112.088815

名称と識別子

優先名称: 1-Methyl-1,2-epoxycyclohexane
IUPAC: 1-methyl-7-oxabicyclo[4.1.0]heptane

名称と別名

1-Methyl-1,2-epoxycyclohexaneRefChem:433674677-561-91,2-Epoxy-1-methylcyclohexane1713-33-31-Methyl-7-oxabicyclo[4.1.0]heptane1-Methylcyclohexene oxideMFCD118461211-Methylepoxycyclohexane7-Oxabicyclo[4.1.0]heptane, methyl-1,2-epoxy-1-methyl-cyclohexane7-Oxabicyclo[4.1.0]heptane, 1-methyl-

名称をさらに表示

1-Methyl-1,2-cyclohexene oxide1-Methylcyclohexene epoxideSCHEMBL12626731-Methylcyclohexene 1,2-oxideDTXSID20873233BS-52385NSC-12597SCHEMBL2332410

データベース識別子

CAS: 1713-33-3
PubChem CID: 224243
DTXSID: DTXSID20873233
EC Number: 677-561-9
Nikkaji: J47.462B

物性

構造計算による物性

XLogP: 1.4
極性表面積: 12.5 Å²
水素結合供与体数: 0
水素結合受容体数: 1
回転可能結合数: 0
重原子数: 8
形式電荷: 0
複雑度: 111

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

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

P210, P233, P240, P241, P242, P243, P264, P264+P265, P280, P302+P352, P303+P361+P353, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P235, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.