A1JA9
Summary
| Name: | 2,5-dichlorothiophene-3-sulfonic acid |
| Synonyms: | 2,5-bis(chloranyl)thiophene-3-sulfonic acid |
| Formula: | C4 H2 Cl2 O3 S2 |
| Formal charge: | 0 |
| Formula weight: | 233.093 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2,5-bis(chloranyl)thiophene-3-sulfonic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C4H2Cl2O3S2/c5-3-1-2(4(6)10-3)11(7,8)9/h1H,(H,7,8,9) |
| InChIKey | InChI | 1.06 | UMQSLMSNBMTPJY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O[S](=O)(=O)c1cc(Cl)sc1Cl |
| SMILES | CACTVS | 3.385 | O[S](=O)(=O)c1cc(Cl)sc1Cl |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1c(c(sc1Cl)Cl)S(=O)(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1c(c(sc1Cl)Cl)S(=O)(=O)O |
