Basic information
- CAS
71477-77-5- Standard SMILES
C=CC[C@@H](O)[C@@H]1CC=C(C)C[C@H]1C- InChIKey
VFWGQSZDFUOMQP-IJLUTSLNSA-N- Molecular formula
- C12H20O
- Average molar mass
- 180.29 g/mol
- Monoisotopic mass
- 180.15141526
Names & identifiers
- Preferred name
- 3-Cyclohexene-1-methanol, 4,6-dimethyl-alpha-2-propen-1-yl-
- IUPAC
- (1R)-1-[(1R,6R)-4,6-dimethylcyclohex-3-en-1-yl]but-3-en-1-ol
Names & synonyms
3-Cyclohexene-1-methanol, 4,6-dimethyl-alpha-2-propenyl-71477-77-54,6-Dimethyl-alpha-(2-propenyl)-3-cyclohexene-1-methanol3-Cyclohexene-1-methanol, 4,6-dimethyl-alpha-2-propen-1-yl-RefChem:2787693-Cyclohexene-1-methanol, 4,6-dimethyl-.alpha.-2-propen-1-yl-
Database identifiers
- CAS
71477-77-5- PubChem CID
- 3085477
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 205
Chemistry & industry
Uses & manufacturing
General Manufacturing Information3-Cyclohexene-1-methanol, 4,6-dimethyl-.alpha.-2-propen-1-yl-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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