Basic information
- Standard SMILES
O=C(c1ccc(Br)cc1F)N1CCC(F)(F)C1- InChIKey
WBOSFWGELQTSOM-UHFFFAOYSA-N- Molecular formula
- C11H9BrF3NO
- Average molar mass
- 308.09 g/mol
Names & identifiers
- Preferred name
- 1-(4-Bromo-2-fluorobenzoyl)-3,3-difluoro-pyrrolidine
- IUPAC
- (4-bromo-2-fluorophenyl)-(3,3-difluoropyrrolidin-1-yl)methanone
Names & synonyms
1-(4-bromo-2-fluorobenzoyl)-3,3-difluoro-pyrrolidineSCHEMBL3341019
Database identifiers
- PubChem CID
- 68604102
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 313
Related reactions
4 records
Compound notes
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