1. Primary Information
| English name: | 2,6-Dichloroisonicotinic acid |
| CAS No.: | 5398-44-7 |
| Molecular formula: | C6H3Cl2NO2 |
| Molecular weight: | 192.00 g/mol |
| SMILES: | C1=C(C=C(N=C1Cl)Cl)C(=O)O |
| Structural class: | |
| Other identifiers: |
2,6-dichloroisonicotinic acid 2,6-dichloroisonicotinic acid, calcium salt 2,6-dichloroisonicotinic acid, lithium salt 2,6-dichloroisonicotinic acid, magnesium salt 2,6-dichloroisonicotinic acid, potassium salt |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 1g | 95% | 24 | 2-8°C | in stock | - |
| Kehua Intelligence | 5g | 95% | 60 | 2-8°C | in stock | - |
| Kehua Intelligence | 25g | 95% | 272 | 2-8°C | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
4. International Nomenclature & Identifiers
4.1 IUPAC Name
2,6-dichloropyridine-4-carboxylic acid
4.2 InChI
InChI=1S/C6H3Cl2NO2/c7-4-1-3(6(10)11)2-5(8)9-4/h1-2H,(H,10,11)
4.3 InChIKey
SQSYNRCXIZHKAI-UHFFFAOYSA-N
4.4 Canonical SMILES
C1=C(C=C(N=C1Cl)Cl)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
