CAQ
Summary
| Name: | CATECHOL |
| Synonyms: | 1,2-DIHYDROXYBENZENE |
| Formula: | C6 H6 O2 |
| Formal charge: | 0 |
| Formula weight: | 110.111 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | benzene-1,2-diol |
| OpenEye OEToolkits | 1.5.0 | benzene-1,2-diol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Oc1ccccc1O |
| SMILES_CANONICAL | CACTVS | 3.341 | Oc1ccccc1O |
| SMILES | CACTVS | 3.341 | Oc1ccccc1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(c(c1)O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(c(c1)O)O |
| InChI | InChI | 1.03 | InChI=1S/C6H6O2/c7-5-3-1-2-4-6(5)8/h1-4,7-8H |
| InChIKey | InChI | 1.03 | YCIMNLLNPGFGHC-UHFFFAOYSA-N |
