HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-Propyl-1H-purin-6-amine
Identifiers & Physical Properties
| CAS No. | 23142-12-3 |
|---|---|
| Molecular formula | C8H11N5 |
| Average molar mass | 177.21 g/mol |
| Monoisotopic mass | 177.10144537 g/mol |
| SMILES | CCCn1cnc2nc[nH]c2c1=N |
| InChIKey | VIANEFSGLRJBCS-UHFFFAOYSA-N |
| PubChem CID | 136239708 |
| DTXSID | DTXSID40780935 |
Chemical & Physical Properties
| XLogP | 0.7 |
|---|---|
| Topological polar surface area | 68.1 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 2 |
| Heavy atoms | 13 |
| Formal charge | 0 |
| Complexity | 237 |