2-(3-methyl-4-nitrophenoxy)-1-(1H-pyrazol-1-yl)ethan-1-one
Chemical Structure Depiction of
2-(3-methyl-4-nitrophenoxy)-1-(1H-pyrazol-1-yl)ethan-1-one
2-(3-methyl-4-nitrophenoxy)-1-(1H-pyrazol-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | Y205-8245 |
| Compound Name: | 2-(3-methyl-4-nitrophenoxy)-1-(1H-pyrazol-1-yl)ethan-1-one |
| Molecular Weight: | 261.23 |
| Molecular Formula: | C12 H11 N3 O4 |
| Smiles: | Cc1cc(ccc1[N+]([O-])=O)OCC(n1cccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6277 |
| logD: | 1.6277 |
| logSw: | -2.044 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.862 |
| InChI Key: | ZTBUGQOZOODODI-UHFFFAOYSA-N |