methyl 4,6-dinitro-3-(2,3,3,3-tetrafluoro-2-methoxypropanamido)-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 4,6-dinitro-3-(2,3,3,3-tetrafluoro-2-methoxypropanamido)-1-benzothiophene-2-carboxylate
methyl 4,6-dinitro-3-(2,3,3,3-tetrafluoro-2-methoxypropanamido)-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | 8012-3530 |
| Compound Name: | methyl 4,6-dinitro-3-(2,3,3,3-tetrafluoro-2-methoxypropanamido)-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 455.3 |
| Molecular Formula: | C14 H9 F4 N3 O8 S |
| Smiles: | COC(c1c(c2c(cc(cc2s1)[N+]([O-])=O)[N+]([O-])=O)NC(C(C(F)(F)F)(OC)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8648 |
| logD: | -0.3421 |
| logSw: | -3.593 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 117.22 |
| InChI Key: | OKMZUXVKPLIFCH-ZDUSSCGKSA-N |