3-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propan-1-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propan-1-amine--hydrogen chloride (1/1)
3-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propan-1-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | Y504-8871 |
| Compound Name: | 3-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propan-1-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 236.65 |
| Molecular Formula: | C7 H12 N4 O3 |
| Salt: | HCl |
| Smiles: | COc1c(cn(CCCN)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -0.1279 |
| logD: | -2.3842 |
| logSw: | -0.5092 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.308 |
| InChI Key: | PBLXFPJYQILWOA-UHFFFAOYSA-N |