A1J26
Summary
| Name: | P-Menthane-3,8-diol |
| Synonyms: | (1R,2S,5S)-5-methyl-2-(2-oxidanylpropan-2-yl)cyclohexan-1-ol (1R,2S,5S)-2-(2-hydroxypropan-2-yl)-5-methylcyclohexan-1-ol |
| Formula: | C10 H20 O2 |
| Formal charge: | 0 |
| Formula weight: | 172.265 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (1~{R},2~{S},5~{S})-5-methyl-2-(2-oxidanylpropan-2-yl)cyclohexan-1-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C10H20O2/c1-7-4-5-8(9(11)6-7)10(2,3)12/h7-9,11-12H,4-6H2,1-3H3/t7-,8-,9+/m0/s1 |
| InChIKey | InChI | 1.06 | LMXFTMYMHGYJEI-XHNCKOQMSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@H]1CC[C@@H]([C@H](O)C1)C(C)(C)O |
| SMILES | CACTVS | 3.385 | C[CH]1CC[CH]([CH](O)C1)C(C)(C)O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[C@H]1CC[C@@H]([C@@H](C1)O)C(C)(C)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC1CCC(C(C1)O)C(C)(C)O |
