2-Cyclohexen-1-ol, 3-methyl-6-(1-methylethyl)-, (1R,6R)-rel-

HCID 85568CAS 16721-39-4

部分構造検索類似構造を探す

基本情報

標準SMILES: CC1=C[C@H](O)[C@@H](C(C)C)CC1
InChIKey: HPOHAUWWDDPHRS-ZJUUUORDSA-N
分子式: C10H18O
平均分子量: 154.25 g/mol
単同位体質量: 154.1357652

概要

(+)-trans-Piperitenol is a p-menthane monoterpenoid.

名称と識別子

優先名称: 2-Cyclohexen-1-ol, 3-methyl-6-(1-methylethyl)-, (1R,6R)-rel-
IUPAC: (1R,6R)-3-methyl-6-propan-2-ylcyclohex-2-en-1-ol

名称と別名

2-Cyclohexen-1-ol, 3-methyl-6-(1-methylethyl)-, trans-2-Cyclohexen-1-ol, 3-methyl-6-(1-methylethyl)-, (1R,6R)-rel-RefChem:470845trans-Piperitol(+)-trans-Piperitenol(3R,4R)-Piperitolp-Menth-1-en-3-ol, trans-trans-p-Menth-1-en-3-ol16721-39-4BLT1PGO03M(1R,6R)-6-Isopropyl-3-methyl-cyclohex-2-en-1-olF3D9SL651T

名称をさらに表示

E-Piperitoltrans-6-(Isopropyl)-3-methylcyclohex-2-en-1-olp-Menth-1-en-3-ol, trans-(+/-)-2-Cyclohexen-1-ol, 3-methyl-6-(1-methylethyl)-, (1R,6R)-2-Cyclohexen-1-ol, 3-methyl-6-(1-methylethyl)-, (1R-trans)-65733-28-0Piperitol, trans-(+-)-trans-Piperitol

データベース識別子

CAS: 16721-39-4、65733-28-0
PubChem CID: 85568
DTXSID: DTXSID50884933
ChEBI: CHEBI:60
UNII: BLT1PGO03M、F3D9SL651T
EC Number: 240-777-5
Nikkaji: J259.677F

物性

構造計算による物性

XLogP: 2.1
極性表面積: 20.2 Å²
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: 11
形式電荷: 0
複雑度: 158

安全と法規制

危険有害性情報

Regulatory InformationChemical: 2-Cyclohexen-1-ol, 3-methyl-6-(1-methylethyl)-, trans-

Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia

化学と産業

用途と製造

General Manufacturing Information2-Cyclohexen-1-ol, 3-methyl-6-(1-methylethyl)-, (1R,6R)-rel-: INACTIVE