A1MHR
Summary
| Name: | 2,5-di-(3'-methyl-3'-pentyl)-hydroquinone |
| Synonyms: | 2,5-bis(3-methylpentan-3-yl)benzene-1,4-diol |
| Formula: | C18 H30 O2 |
| Formal charge: | 0 |
| Formula weight: | 278.43 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2,5-bis(3-methylpentan-3-yl)benzene-1,4-diol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C18H30O2/c1-7-17(5,8-2)13-11-16(20)14(12-15(13)19)18(6,9-3)10-4/h11-12,19-20H,7-10H2,1-6H3 |
| InChIKey | InChI | 1.06 | WZTIODSAMDFHIB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCC(C)(CC)c1cc(O)c(cc1O)C(C)(CC)CC |
| SMILES | CACTVS | 3.385 | CCC(C)(CC)c1cc(O)c(cc1O)C(C)(CC)CC |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCC(C)(CC)c1cc(c(cc1O)C(C)(CC)CC)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCC(C)(CC)c1cc(c(cc1O)C(C)(CC)CC)O |
