UB9
Summary
| Name: | 2,6-dimethoxy-4-methylphenol |
| Formula: | C9 H12 O3 |
| Formal charge: | 0 |
| Formula weight: | 168.19 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2,6-dimethoxy-4-methylphenol |
| OpenEye OEToolkits | 2.0.7 | 2,6-dimethoxy-4-methyl-phenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | COc1cc(C)cc(OC)c1O |
| InChI | InChI | 1.06 | InChI=1S/C9H12O3/c1-6-4-7(11-2)9(10)8(5-6)12-3/h4-5,10H,1-3H3 |
| InChIKey | InChI | 1.06 | ZFBNNSOJNZBLLS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cc(C)cc(OC)c1O |
| SMILES | CACTVS | 3.385 | COc1cc(C)cc(OC)c1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc(c(c(c1)OC)O)OC |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(c(c(c1)OC)O)OC |
