2-methyl-3-(3-nitrobenzene-1-sulfonyl)prop-2-enoic acid
Chemical Structure Depiction of
2-methyl-3-(3-nitrobenzene-1-sulfonyl)prop-2-enoic acid
2-methyl-3-(3-nitrobenzene-1-sulfonyl)prop-2-enoic acid
Compound characteristics
| Compound ID: | 8020-3296 |
| Compound Name: | 2-methyl-3-(3-nitrobenzene-1-sulfonyl)prop-2-enoic acid |
| Molecular Weight: | 271.25 |
| Molecular Formula: | C10 H9 N O6 S |
| Smiles: | C\C(=C/S(c1cccc(c1)[N+]([O-])=O)(=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9194 |
| logD: | -2.8426 |
| logSw: | -2.0796 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.064 |
| InChI Key: | HCBZZRVBIVEINA-UHFFFAOYSA-N |