3-(3-nitrophenyl)-1H-pyrazole-4-carbaldehyde
Chemical Structure Depiction of
3-(3-nitrophenyl)-1H-pyrazole-4-carbaldehyde
3-(3-nitrophenyl)-1H-pyrazole-4-carbaldehyde
Compound characteristics
| Compound ID: | R052-2685 |
| Compound Name: | 3-(3-nitrophenyl)-1H-pyrazole-4-carbaldehyde |
| Molecular Weight: | 217.18 |
| Molecular Formula: | C10 H7 N3 O3 |
| Smiles: | C(c1c[nH]nc1c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7807 |
| logD: | 1.7806 |
| logSw: | -2.0113 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.969 |
| InChI Key: | DNSRMBHWRSZMRZ-UHFFFAOYSA-N |