COM
Summary
| Name: | 1-THIOETHANESULFONIC ACID |
| Formula: | C2 H6 O3 S2 |
| Formal charge: | 0 |
| Formula weight: | 142.197 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-sulfanylethanesulfonic acid |
| OpenEye OEToolkits | 1.5.0 | 2-sulfanylethanesulfonic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=S(=O)(O)CCS |
| SMILES_CANONICAL | CACTVS | 3.341 | O[S](=O)(=O)CCS |
| SMILES | CACTVS | 3.341 | O[S](=O)(=O)CCS |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(CS(=O)(=O)O)S |
| SMILES | OpenEye OEToolkits | 1.5.0 | C(CS(=O)(=O)O)S |
| InChI | InChI | 1.03 | InChI=1S/C2H6O3S2/c3-7(4,5)2-1-6/h6H,1-2H2,(H,3,4,5) |
| InChIKey | InChI | 1.03 | ZNEWHQLOPFWXOF-UHFFFAOYSA-N |
