3-methoxy-3-(nitromethyl)-2-benzofuran-1(3H)-one
Chemical Structure Depiction of
3-methoxy-3-(nitromethyl)-2-benzofuran-1(3H)-one
3-methoxy-3-(nitromethyl)-2-benzofuran-1(3H)-one
Compound characteristics
| Compound ID: | 8009-2407 |
| Compound Name: | 3-methoxy-3-(nitromethyl)-2-benzofuran-1(3H)-one |
| Molecular Weight: | 223.18 |
| Molecular Formula: | C10 H9 N O5 |
| Smiles: | COC1(C[N+]([O-])=O)c2ccccc2C(=O)O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9478 |
| logD: | 0.8417 |
| logSw: | -2.185 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.873 |
| InChI Key: | RSAZKHRUKRPGJB-JTQLQIEISA-N |