Basic information
- Standard SMILES
CC(=O)C(=CN(C)C)c1ccc(F)cc1- InChIKey
ATBPYJOCLJKIIB-UHFFFAOYSA-N- Molecular formula
- C12H14FNO
- Average molar mass
- 207.24 g/mol
Names & identifiers
- Preferred name
- 4-(Dimethylamino)-3-(4-fluorophenyl)but-3-en-2-one
- IUPAC
- 4-(dimethylamino)-3-(4-fluorophenyl)but-3-en-2-one
Names & synonyms
SCHEMBL4291334ATBPYJOCLJKIIB-UHFFFAOYSA-N4-(Dimethylamino)-3-(4-fluorophenyl)but-3-en-2-one
Database identifiers
- PubChem CID
- 68989809
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 252
Related reactions
1 records
Compound notes
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