HuagongsheHuagongshe Chemistry Print Report · For research reference only
Propanal, 3-amino-
3-aminopropanal · 3-Aminopropionaldehyde · Propanal, 3-amino-(9CI)
Identifiers & Physical Properties
| CAS No. | 352-92-1 |
|---|---|
| Molecular formula | C3H7NO |
| Average molar mass | 73.09 g/mol |
| Monoisotopic mass | 73.05276384 g/mol |
| SMILES | NCCC=O |
| InChIKey | PCXDJQZLDDHMGX-UHFFFAOYSA-N |
| PubChem CID | 75 |
| ChEBI | CHEBI:18090 |
| DTXSID | DTXSID10188702 |
Chemical & Physical Properties
| XLogP | -1.3 |
|---|---|
| Topological polar surface area | 43.1 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 2 |
| Heavy atoms | 5 |
| Formal charge | 0 |
| Complexity | 28.1 |
| Physical Description | Solid |
| Boiling point | 45-46 °C(Press: 12 Torr) |
| Density | 0.924±0.06 g/cm3(Predicted) |
| pKa (acidity coefficient) | 8.98±0.10(Predicted) |
| FDA UNII | ML707Y407U |