Basic information
- Standard SMILES
CC1=C[C@H](O)[C@H](C(C)C)CC1- InChIKey
HPOHAUWWDDPHRS-UWVGGRQHSA-N- Molecular formula
- C10H18O
- Average molar mass
- 154.25 g/mol
- Monoisotopic mass
- 154.1357652
Overview
Cis-Piperitol is a p-menthane monoterpenoid.
Names & identifiers
- Preferred name
- cis-Piperitol
- IUPAC
- (1R,6S)-3-methyl-6-propan-2-ylcyclohex-2-en-1-ol
- English name
- cis-6-(isopropyl)-3-methylcyclohex-2-en-1-ol
- Molecular formula
- C10H18O
- Molecular weight
- 154.25
Names & synonyms
cis-Piperitol2-Cyclohexen-1-ol, 3-methyl-6-(1-methylethyl)-, (1R,6S)-rel-16721-38-3(1R,6S)-3-methyl-6-propan-2-ylcyclohex-2-en-1-ol2-Cyclohexen-1-ol, 3-methyl-6-(1-methylethyl)-, cis-EINECS 240-775-4DTXSID90884932RefChem:577419DTXCID501024349(+)-cis-Piperitolcis-p-Menth-1-en-3-ol(Z)-Piperitol
Show more names
cis-6-Isopropyl-3-methyl-2-cyclohexen-1-ol
p-Menth-1-en-3-ol, cis-p-Menth-1-en-3-ol, cis-(+)-cis-6-(Isopropyl)-3-methylcyclohex-2-en-1-olFEMA No. 3179, cis-(+)-G7666796PGp-Menth-1-en-3-ol, (3R,4S)-p-Menth-1-en-3-ol, cis-(+/-)-38KW3EQO0M
Database identifiers
- CAS
16721-38-3、34350-53-3- PubChem CID
- 85567
- DTXSID
DTXSID90884932- ChEBI
CHEBI:167403- UNII
- 38KW3EQO0M、G7666796PG
- EC Number
- 240-775-4
- Nikkaji
- J86.007G
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 158
Physicochemical properties
- Melting point
- 28 °C · 28 °C
- Boiling point
- 60 · 60-66 °C(Press: 0.5 Torr)
- Density
- 0.924 · 0.924±0.06 g/cm3(Predicted)
- pka
- 14.7 · 14.70±0.60(Predicted)
- Odor
- 100 % · at 100.00%. herbal
- LogP
- 2.919 · 2.919 (est)
- FDA UNII
- 7666796 PG · G7666796PG
- EPA Substance Registry System
- 2 · 2-Cyclohexen-1-ol, 3-methyl-6-(1-methylethyl)-, (1R,6S)-rel- (16721-38-3)
- TSCA
- TSCA listed
Safety & regulation
Hazard information
Regulatory InformationChemical: 2-Cyclohexen-1-ol, 3-methyl-6-(1-methylethyl)-, cis-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2-Cyclohexen-1-ol, 3-methyl-6-(1-methylethyl)-, (1R,6S)-rel-: INACTIVE
Suppliers1 total
CLEARSYNTH LABS LTD.+91-22-45045900 · [email protected]
Additional notes
DefinitionChEBI: Cis-Piperitol is a p-menthane monoterpenoid.
Related reactions
1 records
Linked notes
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