VF4
Summary
| Name: | (1R,3S)-3-methylcyclohexan-1-ol |
| Formula: | C7 H14 O |
| Formal charge: | 0 |
| Formula weight: | 114.185 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (1R,3S)-3-methylcyclohexan-1-ol |
| OpenEye OEToolkits | 2.0.7 | (1~{R},3~{R})-3-methylcyclohexan-1-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C1(CCCC(C1)C)O |
| InChI | InChI | 1.03 | InChI=1S/C7H14O/c1-6-3-2-4-7(8)5-6/h6-8H,2-5H2,1H3/t6-,7+/m0/s1 |
| InChIKey | InChI | 1.03 | HTSABYAWKQAHBT-NKWVEPMBSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@H]1CCC[C@@H](O)C1 |
| SMILES | CACTVS | 3.385 | C[CH]1CCC[CH](O)C1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[C@@H]1CCC[C@H](C1)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC1CCCC(C1)O |
