Basic information
- CAS
83348-17-8- Standard SMILES
CC(=O)/C=C(/C)CC(C)(C)O- InChIKey
OAHJSCYHJQJALB-ALCCZGGFSA-N- Molecular formula
- C9H16O2
- Average molar mass
- 156.22 g/mol
- Monoisotopic mass
- 156.11502975
Overview
6-Hydroxy-4,6-dimethyl-3-hepten-2-one is a tertiary alcohol.
Names & identifiers
- Preferred name
- 6-Hydroxy-4,6-dimethyl-3-hepten-2-one
- IUPAC
- (Z)-6-hydroxy-4,6-dimethylhept-3-en-2-one
Names & synonyms
6-Hydroxy-4,6-dimethyl-3-hepten-2-one(3Z)-6-hydroxy-4,6-dimethylhept-3-en-2-one83348-17-8RefChem:104724CHEBI:171763(Z)-6-hydroxy-4,6-dimethylhept-3-en-2-one
Database identifiers
- CAS
83348-17-8- PubChem CID
- 11615204
- ChEBI
CHEBI:171763
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 178
Chemistry & industry
Pharmacology
Cellular LocationsCytoplasm
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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