Basic information
- CAS
67082-00-2- Standard SMILES
O=C(CCc1ccccc1)c1ccc(C(F)(F)F)cc1- InChIKey
TUQLTYUJYXYIKF-UHFFFAOYSA-N- Molecular formula
- C16H13F3O
- Average molar mass
- 278.27 g/mol
- Monoisotopic mass
- 278.09184952
Names & identifiers
- Preferred name
- 3-Phenyl-4'-trifluoromethylpropiophenone
- IUPAC
- 3-phenyl-1-[4-(trifluoromethyl)phenyl]propan-1-one
- English name
- 3-Phenyl-4'-trifluoromethylpropiophenone
- Molecular formula
- C16H13F3O
- Molecular weight
- 278.27
Names & synonyms
3-PHENYL-4'-TRIFLUOROMETHYLPROPIOPHENONE67082-00-2DTXSID50469289RefChem:281752DTXCID004201083-phenyl-1-[4-(trifluoromethyl)phenyl]propan-1-oneMFCD038429443-phenyl-1-(4-(trifluoromethyl)phenyl)propan-1-oneSCHEMBL3609466AKOS012085488HS-6136PD148011
Show more names
1-Propanone, 3-phenyl-1-[4-(trifluoromethyl)phenyl]-
F205599SK5
Database identifiers
- CAS
67082-00-2- PubChem CID
- 11601557
- DTXSID
DTXSID50469289- Nikkaji
- J1.556.655H
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 310
Chemistry & industry
Suppliers2 total
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
2 records
Compound notes
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