3-formylphenyl 4-methylbenzene-1-sulfonate
Chemical Structure Depiction of
3-formylphenyl 4-methylbenzene-1-sulfonate
3-formylphenyl 4-methylbenzene-1-sulfonate
Compound characteristics
Compound ID: | 0682-0055 |
Compound Name: | 3-formylphenyl 4-methylbenzene-1-sulfonate |
Molecular Weight: | 276.31 |
Molecular Formula: | C14 H12 O4 S |
Smiles: | [H]C(c1cccc(c1)OS(c1ccc(C)cc1)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.97 |
logD: | 2.97 |
logSw: | -3.2292 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 50.159 |
InChI Key: | BZXNAHUPQGDCMT-UHFFFAOYSA-N |