HuagongsheHuagongshe Chemistry Print Report · For research reference only
2-(3-Methylphenyl)-5-methyl-1,3-thiazole-4-carboxylic acid
Identifiers & Physical Properties
| Molecular formula | C12H11NO2S |
|---|---|
| Average molar mass | 233.29 g/mol |
| SMILES | Cc1cccc(-c2nc(C(=O)O)c(C)s2)c1 |
| InChIKey | BRCDIHVTPKLIQZ-UHFFFAOYSA-N |
| PubChem CID | 22494271 |
Chemical & Physical Properties
| XLogP | 3.2 |
|---|---|
| Topological polar surface area | 78.4 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 2 |
| Heavy atoms | 16 |
| Formal charge | 0 |
| Complexity | 272 |