HuagongsheHuagongshe Chemistry Print Report · For research reference only
N-[4-(butan-2-yl)phenyl]-2,4-dichlorobenzamide
N-(4-SEC-BUTYL-PHENYL)-2,4-DICHLORO-BENZAMIDE · N-[4-(butan-2-yl)phenyl]-2,4-dichlorobenzamide · Benzamide, 2,4-dichloro-N-[4-(1-methylpropyl)phenyl]-
![N-[4-(butan-2-yl)phenyl]-2,4-dichlorobenzamide molecular structure](/img/chemical/3111237.png)
Identifiers & Physical Properties
| CAS No. | 346719-81-1 |
|---|---|
| Molecular formula | C17H17Cl2NO |
| Average molar mass | 322.2 g/mol |
| Monoisotopic mass | 321.0687196 g/mol |
| SMILES | CCC(C)c1ccc(NC(=O)c2ccc(Cl)cc2Cl)cc1 |
| InChIKey | KBPRDEZYMSWXKE-UHFFFAOYSA-N |
| PubChem CID | 3111237 |
| EC No. | 141-281-0 |
Chemical & Physical Properties
| XLogP | 5.7 |
|---|---|
| Topological polar surface area | 29.1 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 1 |
| Rotatable bonds | 4 |
| Heavy atoms | 21 |
| Formal charge | 0 |
| Complexity | 342 |
| Boiling point | 376.3±42.0 °C(Predicted) |
| Density | 1.245±0.06 g/cm3(Predicted) |
| pKa (acidity coefficient) | 12.14±0.70(Predicted) |