Basic information
- CAS
87908-64-3- Standard SMILES
O=C1CCCCC1C(=O)c1ccc(C(F)(F)F)cc1- InChIKey
QOOGSUPXWRVDSF-UHFFFAOYSA-N- Molecular formula
- C14H13F3O2
- Average molar mass
- 270.25 g/mol
- Monoisotopic mass
- 270.08676414
Names & identifiers
- Preferred name
- 2-[4-(Trifluoromethyl)benzoyl]cyclohexan-1-one
- IUPAC
- 2-[4-(trifluoromethyl)benzoyl]cyclohexan-1-one
Names & synonyms
2-[4-(Trifluoromethyl)benzoyl]cyclohexan-1-one87908-64-3SCHEMBL10740705DTXSID606036322-[4-(trifluoromethyl)benzoyl]cyclohexanone
Database identifiers
- CAS
87908-64-3- PubChem CID
- 20211899
- DTXSID
DTXSID60603632
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 354
Related reactions
2 records
Compound notes
Loading…