Basic information
- Standard SMILES
O=C(OC(=Cc1ccncc1)c1ccc(F)cc1)c1ccc(F)cc1- InChIKey
BEDLEDXEBGAQQZ-UHFFFAOYSA-N- Molecular formula
- C20H13F2NO2
- Average molar mass
- 337.3 g/mol
Names & identifiers
- Preferred name
- 1-(4-Fluorophenyl)-2-(4-pyridyl)vinyl 4-fluorobenzoate
- IUPAC
- [1-(4-fluorophenyl)-2-pyridin-4-ylethenyl] 4-fluorobenzoate
Names & synonyms
SCHEMBL2932011BEDLEDXEBGAQQZ-UHFFFAOYSA-N1-(4-Fluorophenyl)-2-(4-pyridyl)vinyl 4-fluorobenzoate
Database identifiers
- PubChem CID
- 68445862
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 460
Related reactions
5 records
Compound notes
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