Basic information
- Standard SMILES
CC(=CN(C)C)C(=O)c1cccc(C(F)(F)F)c1- InChIKey
YVUJNNQPFXKJLU-UHFFFAOYSA-N- Molecular formula
- C13H14F3NO
- Average molar mass
- 257.25 g/mol
- Monoisotopic mass
- 257.10274856
Names & identifiers
- Preferred name
- 3-Dimethylamino-2-methyl-3'-(trifluoromethyl)acrylophenone
- IUPAC
- 3-(dimethylamino)-2-methyl-1-[3-(trifluoromethyl)phenyl]prop-2-en-1-one
Names & synonyms
3-dimethylamino-2-methyl-3'-(trifluoromethyl)acrylophenoneSCHEMBL114659843-dimethylamino-2-methyl-3'-(trifluoromethyl) acrylophenone
Database identifiers
- PubChem CID
- 54529942
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 334
Related reactions
8 records
Compound notes
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