HuagongsheHuagongshe Chemistry Print Report · For research reference only
n'-Benzylidene-4-chlorobenzohydrazide
N'-BENZYLIDENE-4-CHLOROBENZOHYDRAZIDE · Benzoic acid,4-chloro-, 2-(phenylmethylene)hydrazide
Identifiers & Physical Properties
| CAS No. | 31061-81-1 |
|---|---|
| Molecular formula | C14H11ClN2O |
| Average molar mass | 258.7 g/mol |
| Monoisotopic mass | 258.0559907 g/mol |
| SMILES | O=C(N/N=C/c1ccccc1)c1ccc(Cl)cc1 |
| InChIKey | UDQISSHIEPUOLJ-MHWRWJLKSA-N |
| PubChem CID | 6861476 |
Chemical & Physical Properties
| XLogP | 3.2 |
|---|---|
| Topological polar surface area | 41.5 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 3 |
| Heavy atoms | 18 |
| Formal charge | 0 |
| Complexity | 292 |
| Melting point | 135-136 °C |
| Density | 1.192±0.14 g/cm3(Temp: 25 °CPress: 760 Torr)(predicted) |
| pKa (acidity coefficient) | 11.916±0.46(predicted) |