Basic information
- Standard SMILES
CC(C)(C)c1ccc(-c2cccc3c2CCC3=O)cc1- InChIKey
NQKSXBGZCFLAAK-UHFFFAOYSA-N- Molecular formula
- C19H20O
- Average molar mass
- 264.4 g/mol
- Monoisotopic mass
- 264.15141526
Names & identifiers
- Preferred name
- 4-(4-tert-Butyl-phenyl)-indan-1-one
- IUPAC
- 4-(4-tert-butylphenyl)-2,3-dihydroinden-1-one
Names & synonyms
SCHEMBL23854334-(4'-tert-butylphenyl)indanoneNQKSXBGZCFLAAK-UHFFFAOYSA-N4-(4-tert-Butyl-phenyl)-indan-1-one
Database identifiers
- PubChem CID
- 22990519
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 356
Related reactions
5 records
Compound notes
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