3-nitro-2-phenylpropyl benzenesulfonate
Chemical Structure Depiction of
3-nitro-2-phenylpropyl benzenesulfonate
3-nitro-2-phenylpropyl benzenesulfonate
Compound characteristics
| Compound ID: | 8007-3211 |
| Compound Name: | 3-nitro-2-phenylpropyl benzenesulfonate |
| Molecular Weight: | 321.35 |
| Molecular Formula: | C15 H15 N O5 S |
| Smiles: | C(C(COS(c1ccccc1)(=O)=O)c1ccccc1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6847 |
| logD: | 2.4386 |
| logSw: | -2.9467 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.975 |
| InChI Key: | INNMVQLCSBVBHB-AWEZNQCLSA-N |