(4R,6R)-tert-Butyl-6-cyanomethyl-2,2-dimethyl-1,3-dioxane-4-acetate
- Product Name(4R,6R)-tert-Butyl-6-cyanomethyl-2,2-dimethyl-1,3-dioxane-4-acetate
- CAS125971-94-0
- MFC14H23NO4
- MW269.34
- EINECS425-780-3
- MOL File125971-94-0.mol
Chemical Properties
| Melting point | 65-69 °C(lit.) |
| Boiling point | 364.1±17.0 °C(Predicted) |
| Density | 1.016±0.06 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| solubility | soluble in Chloroform |
| form | powder to crystal |
| color | White to Almost white |
| optical activity | [α]20/D 1.0°, c = 1 in chloroform |
| InChI | InChI=1S/C14H23NO4/c1-13(2,3)19-12(16)9-11-8-10(6-7-15)17-14(4,5)18-11/h10-11H,6,8-9H2,1-5H3/t10-,11-/m1/s1 |
| InChIKey | DPNRMEJBKMQHMC-GHMZBOCLSA-N |
| SMILES | O1[C@H](CC#N)C[C@H](CC(OC(C)(C)C)=O)OC1(C)C |
| CAS DataBase Reference | 125971-94-0(CAS DataBase Reference) |
Safety Information
| Safety Statements | 24/25 |
| WGK Germany | 3 |
| HS Code | 29329990 |
| Storage Class | 11 - Combustible Solids |
