1-(2-hydroxy-5-methoxy-3-nitrophenyl)ethan-1-one
Chemical Structure Depiction of
1-(2-hydroxy-5-methoxy-3-nitrophenyl)ethan-1-one
1-(2-hydroxy-5-methoxy-3-nitrophenyl)ethan-1-one
Compound characteristics
| Compound ID: | 8020-4277 |
| Compound Name: | 1-(2-hydroxy-5-methoxy-3-nitrophenyl)ethan-1-one |
| Molecular Weight: | 211.17 |
| Molecular Formula: | C9 H9 N O5 |
| Smiles: | CC(c1cc(cc(c1O)[N+]([O-])=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9751 |
| logD: | 1.4738 |
| logSw: | -2.0933 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.169 |
| InChI Key: | JCPSCOLEARDZDX-UHFFFAOYSA-N |