
77-91-8
| Name | Choline dihydrogencitrate salt |
| CAS | 77-91-8 |
| EINECS(EC#) | 201-068-6 |
| Molecular Formula | C21H47N3O10 |
| MDL Number | MFCD00038734 |
| Molecular Weight | 501.61 |
| MOL File | 77-91-8.mol |
Chemical Properties
| Appearance | White crystalline powder |
| Melting point | 105-107.5° |
| storage temp. | 2-8°C |
| solubility | DMSO (Slightly, Heated), Methanol (Slightly), Water (Slightly) |
| form | Solid |
| color | White to Off-White |
| Water Solubility | almost transparency |
| Merck | 2207 |
| Stability: | Hygroscopic |
| InChI | InChI=1S/C6H8O7.C5H14NO/c7-3(8)1-6(13,5(11)12)2-4(9)10;1-6(2,3)4-5-7/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);7H,4-5H2,1-3H3/q;+1/p-1 |
| InChIKey | WRPUOFKIGGWQIJ-UHFFFAOYSA-M |
| SMILES | C(O)(C(=O)O)(CC([O-])=O)CC(=O)O.C(CO)[N+](C)(C)C |
| LogP | -1.721 (est) |
| CAS DataBase Reference | 77-91-8(CAS DataBase Reference) |
| EPA Substance Registry System | 77-91-8(EPA Substance) |
Safety Data
| Symbol(GHS) | ![]() GHS07 |
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 |
| Hazard Codes | Xi |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 2 |
| RTECS | GA2582000 |
| TSCA | TSCA listed |
| REACH Registrations | Active |
| HS Code | 29231000 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
