1. Primary Information
| English name: | Dimethyl malonate |
| CAS No.: | 108-59-8 |
| Molecular formula: | C5H8O4 |
| Molecular weight: | 132.11 g/mol |
| SMILES: | COC(=O)CC(=O)OC |
| Structural class: | |
| Other identifiers: |
dimethyl malonate methyl malonate |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 250mg | GC≥98% | 256 | 2-8℃ | in stock | - |
| Kehua Intelligence | 100ml | CP，98% | 24 | 2-8℃ | in stock | - |
| Kehua Intelligence | 500ml | CP，98% | 64 | 2-8℃ | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
4. International Nomenclature & Identifiers
4.1 IUPAC Name
dimethyl propanedioate
4.2 InChI
InChI=1S/C5H8O4/c1-8-4(6)3-5(7)9-2/h3H2,1-2H3
4.3 InChIKey
BEPAFCGSDWSTEL-UHFFFAOYSA-N
4.4 Canonical SMILES
COC(=O)CC(=O)OC
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
