1. Primary Information
| English name: | Divalproex Sodium |
| CAS No.: | 76584-70-8 |
| Molecular formula: | C16H31NAO4 |
| Molecular weight: | 310.40 g/mol |
| SMILES: | CCCC(CCC)C(=O)O.CCCC(CCC)C(=O)[O-].[Na+] |
| Structural class: | |
| Other identifiers: |
2 Propylpentanoic Acid 2-Propylpentanoic Acid Calcium Valproate Convulsofin Depakene |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 100mg | 98% | 440 | RT | in stock | - |
| Kehua Intelligence | 250mg | 98% | 720 | RT | in stock | - |
| Kehua Intelligence | 1g | 98% | 1920 | RT | in stock | - |
| Kehua Intelligence | 5g | 98% | 5600 | RT | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
Coming soon
4. International Nomenclature & Identifiers
4.1 IUPAC Name
sodium;2-propylpentanoate;2-propylpentanoic acid
4.2 InChI
InChI=1S/2C8H16O2.Na/c2*1-3-5-7(6-4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;;+1/p-1
4.3 InChIKey
MSRILKIQRXUYCT-UHFFFAOYSA-M
4.4 Canonical SMILES
CCCC(CCC)C(=O)O.CCCC(CCC)C(=O)[O-].[Na+]
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 --
