HuagongsheHuagongshe Chemistry Print Report · For research reference only
3,5-Diaminohexanoic acid
Identifiers & Physical Properties
| CAS No. | 17027-83-7 |
|---|---|
| Molecular formula | C6H14N2O2 |
| Average molar mass | 146.19 g/mol |
| Monoisotopic mass | 146.10552769 g/mol |
| SMILES | CC(N)CC(N)CC(=O)O |
| InChIKey | NGDLSXMSQYUVSJ-UHFFFAOYSA-N |
| PubChem CID | 331 |
| DTXSID | DTXSID70937753 |
Chemical & Physical Properties
| XLogP | -3.6 |
|---|---|
| Topological polar surface area | 89.3 |
| Hydrogen bond donors | 3 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 4 |
| Heavy atoms | 10 |
| Formal charge | 0 |
| Complexity | 116 |