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29606-79-9

29606-79-9 Structure

29606-79-9 Structure
IdentificationBack Directory
[Name]

trans-5-methyl-2-(1-methylvinyl)cyclohexan-1-one
[CAS]

29606-79-9
[Synonyms]

trans-Isopulegone
p-menth-8-en-3-one
trans-5-methyl-2-(1-methylvinyl)cyclohexan-1-one
Cyclohexanone, 5-methyl-2-(1-methylethenyl)-, trans
Cyclohexanone, 5-methyl-2-(1-methylethenyl)-, (2R,5S)-rel-
[EINECS(EC#)]

249-725-6
[Molecular Formula]

C10H16O
[MDL Number]

MFCD01715733
[MOL File]

29606-79-9.mol
[Molecular Weight]

152.233
Chemical PropertiesBack Directory
[Boiling point ]

234.73°C (rough estimate)
[density ]

0.9198
[FEMA ]

2964 | ISOPULEGONE
[refractive index ]

1.4675 (estimate)
[Odor]

at 100.00 %. peppermint fresh herbal
[Odor Type]

minty
[JECFA Number]

754
[LogP]

2.47
[CAS DataBase Reference]

29606-79-9
Hazard InformationBack Directory
[Description]

Synthesis: The structure of isopulegone was defined by Tiemann and Schmidt as well as by Hugh, Kon, and Linstead; usually prepared from isopulegol.
[Occurrence]

Natural isopulegone is dextrorotatory; reported found in the essential oils from leaves of Bystropogon mollis, peppermint, pennyroyal and other mentha oils.
[Definition]

ChEBI: P-menth-8-en-3-one is a p-menthane monoterpenoid.
[Preparation]

The structure of isopulegone was defined by Tiemann and Schmidt as well as by Hugh, Kon and Linstead; usually prepared from isopulegol
Safety DataBack Directory
[Toxicity]

LDLo intravenous in dog: 450mg/kg
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