HuagongsheHuagongshe Chemistry Print Report · For research reference only
Chloral p-chlorophenyl isocyanate dodecyl isocyanate
Identifiers & Physical Properties
| Molecular formula | C22H30Cl4N2O3 |
|---|---|
| Average molar mass | 512.3 g/mol |
| Monoisotopic mass | 510.101054 g/mol |
| SMILES | CCCCCCCCCCCCN=C=O.O=C=Nc1ccc(Cl)cc1.O=CC(Cl)(Cl)Cl |
| InChIKey | NZFYPIGTYIETJP-UHFFFAOYSA-N |
| PubChem CID | 86732905 |
Chemical & Physical Properties
| Topological polar surface area | 75.9 |
|---|---|
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 5 |
| Rotatable bonds | 12 |
| Heavy atoms | 31 |
| Formal charge | 0 |
| Complexity | 362 |