D6K
Summary
| Name: | (4~{S},6~{R})-2,2,6-trimethyl-1,3-dioxan-4-ol |
| Formula: | C7 H14 O3 |
| Formal charge: | 0 |
| Formula weight: | 146.184 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | (4~{S},6~{R})-2,2,6-trimethyl-1,3-dioxan-4-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C7H14O3/c1-5-4-6(8)10-7(2,3)9-5/h5-6,8H,4H2,1-3H3/t5-,6+/m1/s1 |
| InChIKey | InChI | 1.03 | YZGBOJCVSXYSKT-RITPCOANSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@@H]1C[C@@H](O)OC(C)(C)O1 |
| SMILES | CACTVS | 3.385 | C[CH]1C[CH](O)OC(C)(C)O1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | C[C@@H]1C[C@H](OC(O1)(C)C)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | CC1CC(OC(O1)(C)C)O |
