Basic information
- Standard SMILES
CC(=O)c1ccc(-c2ccc3c(c2)C(C)(C)CC3=O)cc1- InChIKey
PBHXVQIAWZSBBE-UHFFFAOYSA-N- Molecular formula
- C19H18O2
- Average molar mass
- 278.3 g/mol
- Monoisotopic mass
- 278.13067981
Names & identifiers
- Preferred name
- 5-(4-Acetylphenyl)-3,3-dimethylindan-1-one
- IUPAC
- 5-(4-acetylphenyl)-3,3-dimethyl-2H-inden-1-one
Names & synonyms
SCHEMBL4426122PBHXVQIAWZSBBE-UHFFFAOYSA-N5-(4-acetylphenyl)-3,3-dimethylindan-1-one
Database identifiers
- PubChem CID
- 69039115
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 429
Related reactions
2 records
Compound notes
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