4-nitrophenyl (4-nitrophenyl)methanesulfonate
Chemical Structure Depiction of
4-nitrophenyl (4-nitrophenyl)methanesulfonate
4-nitrophenyl (4-nitrophenyl)methanesulfonate
Compound characteristics
| Compound ID: | 1165-0486 |
| Compound Name: | 4-nitrophenyl (4-nitrophenyl)methanesulfonate |
| Molecular Weight: | 338.29 |
| Molecular Formula: | C13 H10 N2 O7 S |
| Smiles: | C(c1ccc(cc1)[N+]([O-])=O)S(=O)(=O)Oc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.5643 |
| logD: | 2.5643 |
| logSw: | -2.6866 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 101.839 |
| InChI Key: | KCKMPYMUEILKMO-UHFFFAOYSA-N |