1. Primary Information
| English name: | 3-Aminobutanoic acid |
| CAS No.: | 541-48-0 |
| Molecular formula: | C4H9NO2 |
| Molecular weight: | 103.12 g/mol |
| SMILES: | CC(CC(=O)O)N |
| Structural class: | |
| Other identifiers: |
3-aminobutyric acid 3-aminobutyric acid, (+-)-isomer 3-aminobutyric acid, (R)-isomer 3-aminobutyric acid, (S)-isomer BABA cpd |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 1g | BR，98% | 80 | RT | in stock | - |
| Kehua Intelligence | 5g | BR，98% | 256 | RT | in stock | - |
| Kehua Intelligence | 25g | BR，98% | 920 | RT | in stock | - |
| Kehua Intelligence | 100g | BR，98% | 3120 | RT | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
4. International Nomenclature & Identifiers
4.1 IUPAC Name
3-aminobutanoic acid
4.2 InChI
InChI=1S/C4H9NO2/c1-3(5)2-4(6)7/h3H,2,5H2,1H3,(H,6,7)
4.3 InChIKey
OQEBBZSWEGYTPG-UHFFFAOYSA-N
4.4 Canonical SMILES
CC(CC(=O)O)N
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
