4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
Chemical Structure Depiction of
4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
Compound characteristics
| Compound ID: | FF51-1059 |
| Compound Name: | 4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid |
| Molecular Weight: | 182.24 |
| Molecular Formula: | C9 H10 O2 S |
| Smiles: | C1CCc2c(C1)c(cs2)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8082 |
| logD: | 0.9313 |
| logSw: | -2.9571 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.5855 |
| InChI Key: | TUZZQEHPGHKGRJ-UHFFFAOYSA-N |