1-[(4-nitrophenoxy)methyl]-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
1-[(4-nitrophenoxy)methyl]-1H-pyrazole-3-carboxylic acid
1-[(4-nitrophenoxy)methyl]-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | Y507-1014 |
| Compound Name: | 1-[(4-nitrophenoxy)methyl]-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 263.21 |
| Molecular Formula: | C11 H9 N3 O5 |
| Smiles: | C(n1ccc(C(O)=O)n1)Oc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.2996 |
| logD: | -1.892 |
| logSw: | -1.8157 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.391 |
| InChI Key: | LCPFWRACPMSKTR-UHFFFAOYSA-N |