2-chlorophenyl 2,4,6-tri(propan-2-yl)benzene-1-sulfonate
Chemical Structure Depiction of
2-chlorophenyl 2,4,6-tri(propan-2-yl)benzene-1-sulfonate
2-chlorophenyl 2,4,6-tri(propan-2-yl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | 0538-0115 |
| Compound Name: | 2-chlorophenyl 2,4,6-tri(propan-2-yl)benzene-1-sulfonate |
| Molecular Weight: | 394.96 |
| Molecular Formula: | C21 H27 Cl O3 S |
| Smiles: | CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)Oc1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.5566 |
| logD: | 6.5566 |
| logSw: | -6.4353 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.087 |
| InChI Key: | QHAHYRXJZNGFDT-UHFFFAOYSA-N |