TH0
Summary
| Name: | 4-MERCAPTOBENZENE-1,3-DIOL |
| Formula: | C6 H6 O2 S |
| Formal charge: | 0 |
| Formula weight: | 142.176 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 4-sulfanylbenzene-1,3-diol |
| OpenEye OEToolkits | 1.5.0 | 4-sulfanylbenzene-1,3-diol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Oc1ccc(S)c(O)c1 |
| SMILES_CANONICAL | CACTVS | 3.341 | Oc1ccc(S)c(O)c1 |
| SMILES | CACTVS | 3.341 | Oc1ccc(S)c(O)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1O)O)S |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1O)O)S |
| InChI | InChI | 1.03 | InChI=1S/C6H6O2S/c7-4-1-2-6(9)5(8)3-4/h1-3,7-9H |
| InChIKey | InChI | 1.03 | XFTQIEMOLHJTFV-UHFFFAOYSA-N |
