1. Primary Information
| English name: | 2-Ethylbutyric acid |
| CAS No.: | 88-09-5 |
| Molecular formula: | C6H12O2 |
| Molecular weight: | 116.16 g/mol |
| SMILES: | CCC(CC)C(=O)O |
| Structural class: | |
| Other identifiers: |
- |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 250mg | GC≥98% | 352 | 2-8℃ | in stock | - |
| Kehua Intelligence | 25ml | 99% | 72 | 2-8℃ | in stock | - |
| Kehua Intelligence | 100ml | 99% | 184 | 2-8℃ | in stock | - |
| Kehua Intelligence | 1ml | standard for GC, ≥99.5%(GC) | 64 | 2-8℃ | in stock | - |
| Kehua Intelligence | 5ml | standard for GC, ≥99.5%(GC) | 224 | 2-8℃ | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
4. International Nomenclature & Identifiers
4.1 IUPAC Name
2-ethylbutanoic acid
4.2 InChI
InChI=1S/C6H12O2/c1-3-5(4-2)6(7)8/h5H,3-4H2,1-2H3,(H,7,8)
4.3 InChIKey
OXQGTIUCKGYOAA-UHFFFAOYSA-N
4.4 Canonical SMILES
CCC(CC)C(=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
