1-(1H-1,2,4-triazol-1-yl)propan-2-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-(1H-1,2,4-triazol-1-yl)propan-2-one--hydrogen chloride (1/1)
1-(1H-1,2,4-triazol-1-yl)propan-2-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8019-9984 |
| Compound Name: | 1-(1H-1,2,4-triazol-1-yl)propan-2-one--hydrogen chloride (1/1) |
| Molecular Weight: | 161.59 |
| Molecular Formula: | C5 H7 N3 O |
| Salt: | HCl |
| Smiles: | CC(Cn1cncn1)=O |
| Stereo: | ACHIRAL |
| logP: | -0.9565 |
| logD: | -0.9565 |
| logSw: | 0.1794 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.822 |
| InChI Key: | HBAZRGCNSUQWNN-UHFFFAOYSA-N |