Basic information
- Standard SMILES
CC1=C(C)C2=CC(=O)CCC2CC1- InChIKey
FQAJWGSDJAJAOF-UHFFFAOYSA-N- Molecular formula
- C12H16O
- Average molar mass
- 176.25 g/mol
Names & identifiers
- Preferred name
- 7,8-Dimethyl-4,4a,5,6-tetrahydro-2(3H)-naphthalenone
- IUPAC
- 7,8-dimethyl-4,4a,5,6-tetrahydro-3H-naphthalen-2-one
Names & synonyms
SCHEMBL10434496FQAJWGSDJAJAOF-UHFFFAOYSA-N7,8-Dimethyl-4,4a,5,6-tetrahydro-2(3H)-naphthalenone
Database identifiers
- PubChem CID
- 12453979
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 307
Related reactions
1 records
Compound notes
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