4-nitrophenyl 3-chloro-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
4-nitrophenyl 3-chloro-1-benzothiophene-2-carboxylate
4-nitrophenyl 3-chloro-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | 7883-8608 |
| Compound Name: | 4-nitrophenyl 3-chloro-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 333.75 |
| Molecular Formula: | C15 H8 Cl N O4 S |
| Smiles: | c1ccc2c(c1)c(c(C(=O)Oc1ccc(cc1)[N+]([O-])=O)s2)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.9151 |
| logD: | 4.9151 |
| logSw: | -5.1004 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.745 |
| InChI Key: | VLRIDHVOZGOFFY-UHFFFAOYSA-N |