3CE
Summary
| Name: | 3-chlorobenzene-1,2-diol |
| Formula: | C6 H5 Cl O2 |
| Formal charge: | 0 |
| Formula weight: | 144.556 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 11.02 | 3-chlorobenzene-1,2-diol |
| OpenEye OEToolkits | 1.6.1 | 3-chlorobenzene-1,2-diol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 11.02 | Clc1cccc(O)c1O |
| SMILES_CANONICAL | CACTVS | 3.352 | Oc1cccc(Cl)c1O |
| SMILES | CACTVS | 3.352 | Oc1cccc(Cl)c1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1cc(c(c(c1)Cl)O)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1cc(c(c(c1)Cl)O)O |
| InChI | InChI | 1.03 | InChI=1S/C6H5ClO2/c7-4-2-1-3-5(8)6(4)9/h1-3,8-9H |
| InChIKey | InChI | 1.03 | GQKDZDYQXPOXEM-UHFFFAOYSA-N |
