(2-nitrophenyl)methyl 4-methylbenzene-1-sulfonate
Chemical Structure Depiction of
(2-nitrophenyl)methyl 4-methylbenzene-1-sulfonate
(2-nitrophenyl)methyl 4-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | 8004-0331 |
| Compound Name: | (2-nitrophenyl)methyl 4-methylbenzene-1-sulfonate |
| Molecular Weight: | 307.32 |
| Molecular Formula: | C14 H13 N O5 S |
| Smiles: | Cc1ccc(cc1)S(=O)(=O)OCc1ccccc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.33 |
| logD: | 3.33 |
| logSw: | -3.8057 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.408 |
| InChI Key: | MCVVDMSWCQUKEV-UHFFFAOYSA-N |