SAX
Summary
| Name: | 2-(dodecyloxy)-6-hydroxybenzoic acid |
| Formula: | C19 H30 O4 |
| Formal charge: | 0 |
| Formula weight: | 322.439 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-(dodecyloxy)-6-hydroxybenzoic acid |
| OpenEye OEToolkits | 1.7.2 | 2-dodecoxy-6-oxidanyl-benzoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)c1c(O)cccc1OCCCCCCCCCCCC |
| InChI | InChI | 1.03 | InChI=1S/C19H30O4/c1-2-3-4-5-6-7-8-9-10-11-15-23-17-14-12-13-16(20)18(17)19(21)22/h12-14,20H,2-11,15H2,1H3,(H,21,22) |
| InChIKey | InChI | 1.03 | HMYWVVRALHTQJQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CCCCCCCCCCCCOc1cccc(O)c1C(O)=O |
| SMILES | CACTVS | 3.370 | CCCCCCCCCCCCOc1cccc(O)c1C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | CCCCCCCCCCCCOc1cccc(c1C(=O)O)O |
| SMILES | OpenEye OEToolkits | 1.7.2 | CCCCCCCCCCCCOc1cccc(c1C(=O)O)O |
