HT4
Summary
| Name: | 4-methyl-2-sulfanylphenol |
| Formula: | C7 H8 O S |
| Formal charge: | 0 |
| Formula weight: | 140.203 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-methyl-2-sulfanylphenol |
| OpenEye OEToolkits | 1.7.6 | 4-methyl-2-sulfanyl-phenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Oc1ccc(cc1S)C |
| InChI | InChI | 1.03 | InChI=1S/C7H8OS/c1-5-2-3-6(8)7(9)4-5/h2-4,8-9H,1H3 |
| InChIKey | InChI | 1.03 | GWMWXFGQYATKBA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccc(O)c(S)c1 |
| SMILES | CACTVS | 3.385 | Cc1ccc(O)c(S)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | Cc1ccc(c(c1)S)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | Cc1ccc(c(c1)S)O |
