HuagongsheHuagongshe Chemistry Print Report · For research reference only
2-[(2-Chloroethyl)amino]ethyl 12-hydroxyoctadecanoate
![2-[(2-Chloroethyl)amino]ethyl 12-hydroxyoctadecanoate molecular structure](/img/chemical/12373467.png)
Identifiers & Physical Properties
| CAS No. | 62992-51-2 |
|---|---|
| Molecular formula | C22H44ClNO3 |
| Average molar mass | 406 g/mol |
| Monoisotopic mass | 405.300972 g/mol |
| SMILES | CCCCCCC(O)CCCCCCCCCCC(=O)OCCNCCCl |
| InChIKey | HTOYRSAPALUQJU-UHFFFAOYSA-N |
| PubChem CID | 12373467 |
| DTXSID | DTXSID60494961 |
Chemical & Physical Properties
| XLogP | 6.8 |
|---|---|
| Topological polar surface area | 58.6 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 22 |
| Heavy atoms | 27 |
| Formal charge | 0 |
| Complexity | 316 |