Basic information
- Standard SMILES
Cc1cc(CCC(=O)F)nn1C(OCc1ccc(Cl)cc1)c1cccc(Cl)c1- InChIKey
BFISNEMGRMMKRM-UHFFFAOYSA-N- Molecular formula
- C21H19Cl2FN2O2
- Average molar mass
- 421.3 g/mol
Names & identifiers
- Preferred name
- 3-{1-[5-Chloro-(4-chloro-benzyloxy)-benzyl]-5-methyl-1H-pyrazol-3-YL}-propionyl fluoride
- IUPAC
- 3-[1-[(3-chlorophenyl)-[(4-chlorophenyl)methoxy]methyl]-5-methylpyrazol-3-yl]propanoyl fluoride
Names & synonyms
BFISNEMGRMMKRM-UHFFFAOYSA-N3-{1-[5-CHLORO-(4-CHLORO-BENZYLOXY)-BENZYL]-5-METHYL-1H-PYRAZOL-3-YL}-PROPIONYL FLUORIDE
Database identifiers
- PubChem CID
- 86667289
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 44.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 505
Related reactions
2 records
Compound notes
Loading…