ethyl 2-[(4-methylbenzene-1-sulfonyl)oxy]-5-nitrobenzoate
Chemical Structure Depiction of
ethyl 2-[(4-methylbenzene-1-sulfonyl)oxy]-5-nitrobenzoate
ethyl 2-[(4-methylbenzene-1-sulfonyl)oxy]-5-nitrobenzoate
Compound characteristics
| Compound ID: | 8010-0452 |
| Compound Name: | ethyl 2-[(4-methylbenzene-1-sulfonyl)oxy]-5-nitrobenzoate |
| Molecular Weight: | 365.36 |
| Molecular Formula: | C16 H15 N O7 S |
| Smiles: | CCOC(c1cc(ccc1OS(c1ccc(C)cc1)(=O)=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7311 |
| logD: | 3.7311 |
| logSw: | -3.9294 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 90.222 |
| InChI Key: | AQUORSRWZGWJHH-UHFFFAOYSA-N |