methyl 5-tert-butyl-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 5-tert-butyl-1-benzothiophene-2-carboxylate
methyl 5-tert-butyl-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | Y203-0025 |
| Compound Name: | methyl 5-tert-butyl-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 248.34 |
| Molecular Formula: | C14 H16 O2 S |
| Smiles: | CC(C)(C)c1ccc2c(c1)cc(C(=O)OC)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.8023 |
| logD: | 4.8023 |
| logSw: | -4.9679 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 22.1591 |
| InChI Key: | WHQDVIGECHJKMV-UHFFFAOYSA-N |