ethyl 4-hydroxy-2-methyl-5-nitrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 4-hydroxy-2-methyl-5-nitrothiophene-3-carboxylate
ethyl 4-hydroxy-2-methyl-5-nitrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 4401-0069 |
| Compound Name: | ethyl 4-hydroxy-2-methyl-5-nitrothiophene-3-carboxylate |
| Molecular Weight: | 231.22 |
| Molecular Formula: | C8 H9 N O5 S |
| Smiles: | CCOC(c1c(c([N+]([O-])=O)sc1C)O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0142 |
| logD: | 1.3736 |
| logSw: | -1.8206 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.922 |
| InChI Key: | ZYOSZUKKBYDORK-UHFFFAOYSA-N |