Basic information
- CAS
3718-55-6- Standard SMILES
CC1CC=CC(O)C1- InChIKey
RABYZONTKHYCAK-UHFFFAOYSA-N- Molecular formula
- C7H12O
- Average molar mass
- 112.17 g/mol
- Monoisotopic mass
- 112.088815
Names & identifiers
- Preferred name
- 2-Cyclohexen-1-ol, 5-methyl-
- IUPAC
- 5-methylcyclohex-2-en-1-ol
Names & synonyms
2-Cyclohexen-1-ol, 5-methyl-3718-55-6DTXSID20326870RefChem:1062913DTXCID102779835-methylcyclohex-2-en-1-olNSC6199401-methyl-cyclohex-3-en-5-olSCHEMBL1659286CHEMBL1995594NSC-619940NCI60_005872
Database identifiers
- CAS
3718-55-6- PubChem CID
- 359231
- DTXSID
DTXSID20326870- ChEMBL
CHEMBL1995594
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 96.6
Experimental & physicochemical properties
SpringerMaterials PropertiesOptical coefficient
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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