1. Primary Information
| English name: | Cholini bitartras |
| CAS No.: | 87-67-2 |
| Molecular formula: | C9H19NO7 |
| Molecular weight: | 253.25 g/mol |
| SMILES: | C[N+](C)(C)CCO.C(C(C(=O)[O-])O)(C(=O)O)O |
| Structural class: | |
| Other identifiers: |
2-Hydroxy-N,N,N-trimethylethanaminium Bitartrate, Choline Bursine Chloride, Choline Choline |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 100mg | 98% | 200 | 2-8℃ | in stock | - |
| Kehua Intelligence | 25g | 98%,含二氧化硅稳定剂 | 44 | 2-8℃ | in stock | - |
| Kehua Intelligence | 100g | 98%,含二氧化硅稳定剂 | 136 | 2-8℃ | in stock | - |
| Kehua Intelligence | 500g | 98%,含二氧化硅稳定剂 | 392 | 2-8℃ | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
Coming soon
4. International Nomenclature & Identifiers
4.1 IUPAC Name
2-hydroxyethyl(trimethyl)azanium;2,3,4-trihydroxy-4-oxobutanoate
4.2 InChI
InChI=1S/C5H14NO.C4H6O6/c1-6(2,3)4-5-7;5-1(3(7)8)2(6)4(9)10/h7H,4-5H2,1-3H3;1-2,5-6H,(H,7,8)(H,9,10)/q+1;/p-1
4.3 InChIKey
QWJSAWXRUVVRLH-UHFFFAOYSA-M
4.4 Canonical SMILES
C[N+](C)(C)CCO.C(C(C(=O)[O-])O)(C(=O)O)O
4.5 Isomeric SMILES
-
4.6 SDF file
Coming soon
5. Spectroscopic data
5.1 13C nuclear magnetic resonance (13C NMR)
5.2 1H nuclear magnetic resonance (1H NMR)
5.3 Mass spectrometry (MS)
Coming soon
5.4 Infrared spectroscopy (IR)
Coming soon
5.5 Ultraviolet/visible spectroscopy (UV/Vis)
Coming soon
-- No 3D model data available --
