Glycodeoxycholic-2,2,4,4-d4 acid
- Product NameGlycodeoxycholic-2,2,4,4-d4 acid
- CAS1069132-37-1
- MFC26H39D4NO5
- MW453.65
- EINECS
- MOL FileMol File
Chemical Properties
| Boiling point | 655.572±50.00 °C(Press: 760.00 Torr)(predicted) |
| Density | 1.162±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted) |
| storage temp. | -20°C |
| solubility | DMSO (Slightly), Ethanol (Slightly), Methanol (Slightly) |
| form | Solid |
| pka | 3.582±0.10(predicted) |
| color | White to Off-White |
| InChIKey | WVULKSPCQVQLCU-JHVXYEQYSA-N |
| SMILES | [H][C@@]12[C@]([C@](CC([2H])([2H])[C@@H](O)C3([2H])[2H])(C)[C@]3([H])CC2)([H])C[C@H](O)[C@@]4(C)[C@@]1([H])CC[C@]4([H])[C@]([H])(C)CCC(NCC(O)=O)=O |
| CAS Number Unlabeled | 360-65-6 |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26 |
| WGK Germany | 3 |
| Storage Class | 11 - Combustible Solids |