3-chlorophenyl 2,4,6-tri(propan-2-yl)benzene-1-sulfonate
Chemical Structure Depiction of
3-chlorophenyl 2,4,6-tri(propan-2-yl)benzene-1-sulfonate
3-chlorophenyl 2,4,6-tri(propan-2-yl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | 2092-1373 |
| Compound Name: | 3-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)Oc1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.9863 |
| logD: | 6.9863 |
| logSw: | -6.6548 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36 |
| InChI Key: | AGGRFBLVUQIHKL-UHFFFAOYSA-N |