HuagongsheHuagongshe Chemistry Print Report · For research reference only
(2,4-Dimethoxy-1,3-benzothiazol-7-yl)acetic acid
Identifiers & Physical Properties
| Molecular formula | C11H11NO4S |
|---|---|
| Average molar mass | 253.28 g/mol |
| Monoisotopic mass | 253.04087901 g/mol |
| SMILES | COc1nc2c(OC)ccc(CC(=O)O)c2s1 |
| InChIKey | FCZVLIKWKUWGER-UHFFFAOYSA-N |
| PubChem CID | 19082155 |
Chemical & Physical Properties
| XLogP | 2.1 |
|---|---|
| Topological polar surface area | 96.9 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 6 |
| Rotatable bonds | 4 |
| Heavy atoms | 17 |
| Formal charge | 0 |
| Complexity | 289 |