cis-Dihydrocarvone
Basic information
- CAS
3792-53-8- Standard SMILES
C=C(C)[C@H]1CC[C@@H](C)C(=O)C1- InChIKey
AZOCECCLWFDTAP-BDAKNGLRSA-N- Molecular formula
- C10H16O
- Average molar mass
- 152.23 g/mol
- Monoisotopic mass
- 152.12011513
Overview
(-)-isodihydrocarvone is the (1R,4S)-stereoisomer of dihydrocarvone. It is an enantiomer of a (+)-isodihydrocarvone.
Names & identifiers
- Preferred name
- cis-Dihydrocarvone
- IUPAC
- cis-(2R,5S)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-one
Names & synonyms
cis-DihydrocarvoneDihydrocarvone, cis-3792-53-8EXB37ICH9GMenth-8-en-2-one, cis-p-p-Menth-8-en-2-one, cis-CIS-P-MENTH-8-EN-2-ONECyclohexanone, 2-methyl-5-(1-methylethenyl)-, cis-3-Isopropenyl-6-methylcyclohexanone, cis-2-Methyl-5-(1-methylethenyl)cyclohexanone, cis-RefChem:577394(-)-isodihydrocarvone
Show more names
(1R,4S)-Iso-dihydrocarvone53796-79-5(1R,4S)-isodihydrocarvone(1R,4S)-(-)-Isodihydrocarvonecis-(-)-DihydrocarvoneCyclohexanone, 2-methyl-5-(1-methylethenyl)-, (2R,5S)-Dihydrocarvone, cis-(-)-(2R,5S)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-one
Database identifiers
- CAS
3792-53-8、53796-79-5、5948-04-9- PubChem CID
- 443181
- DTXSID
DTXSID50332060- ChEBI
CHEBI:155- UNII
- EXB37ICH9G、F690VV17TL
- EC Number
- 609-490-6
- Nikkaji
- J995.645J
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 181
Experimental & physicochemical properties
LipidsLipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> C10 isoprenoids (monoterpenes) [PR0102]
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: Cyclohexanone, 2-methyl-5-(1-methylethenyl)-, trans-
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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