ethyl 3-chloro-6-nitro-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
ethyl 3-chloro-6-nitro-1-benzothiophene-2-carboxylate
ethyl 3-chloro-6-nitro-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | F235-0858 |
| Compound Name: | ethyl 3-chloro-6-nitro-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 285.7 |
| Molecular Formula: | C11 H8 Cl N O4 S |
| Smiles: | CCOC(c1c(c2ccc(cc2s1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0737 |
| logD: | 4.0737 |
| logSw: | -4.6786 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.12 |
| InChI Key: | RMXOKWDCOUZLTK-UHFFFAOYSA-N |