3,3-Bis(3-fluorophenyl)propionic acid
Basic information
- Standard SMILES
O=C(O)CC(c1cccc(F)c1)c1cccc(F)c1- InChIKey
YELYXULWCFELQI-UHFFFAOYSA-N- Molecular formula
- C15H12F2O2
- Average molar mass
- 262.25 g/mol
- Monoisotopic mass
- 262.08053595
Names & identifiers
- Preferred name
- 3,3-Bis(3-fluorophenyl)propionic acid
- IUPAC
- 3,3-bis(3-fluorophenyl)propanoic acid
Names & synonyms
SCHEMBL5149908YELYXULWCFELQI-UHFFFAOYSA-N3,3-bis(3-fluorophenyl)propionic acid
Database identifiers
- PubChem CID
- 22015763
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 287
Related reactions
1 records
Compound notes
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