LA7
Summary
| Name: | 2-(hydroxymethyl)-6-methylpyridin-3-ol |
| Formula: | C7 H9 N O2 |
| Formal charge: | 0 |
| Formula weight: | 139.152 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-(hydroxymethyl)-6-methylpyridin-3-ol |
| OpenEye OEToolkits | 1.7.6 | 2-(hydroxymethyl)-6-methyl-pyridin-3-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Oc1ccc(nc1CO)C |
| InChI | InChI | 1.03 | InChI=1S/C7H9NO2/c1-5-2-3-7(10)6(4-9)8-5/h2-3,9-10H,4H2,1H3 |
| InChIKey | InChI | 1.03 | PAGTXDLKXRBHFL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccc(O)c(CO)n1 |
| SMILES | CACTVS | 3.385 | Cc1ccc(O)c(CO)n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | Cc1ccc(c(n1)CO)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | Cc1ccc(c(n1)CO)O |
