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 |