1. Primary Information
| English name: | 2,3,5-Triiodobenzoic acid |
| CAS No.: | 88-82-4 |
| Molecular formula: | C7H3I3O2 |
| Molecular weight: | 499.81 g/mol |
| SMILES: | C1=C(C=C(C(=C1C(=O)O)I)I)I |
| Structural class: | |
| Other identifiers: |
2,3,5-triiodobenzoic acid 2,3,5-triiodobenzoic acid, 14C-labeled 2,3,5-triiodobenzoic acid, ammonia salt 2,3,5-triiodobenzoic acid, potassium salt 2,3,5-triiodobenzoic acid, sodium salt |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 250mg | 98% | 320 | -20℃ | in stock | - |
| Kehua Intelligence | 5g | BR，98% | 68 | -20℃ | in stock | - |
| Kehua Intelligence | 25g | BR，98% | 232 | -20℃ | in stock | - |
| Kehua Intelligence | 100g | BR，98% | 760 | -20℃ | in stock | - |
| Kehua Intelligence | 500g | BR，98% | 3040 | -20℃ | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
4. International Nomenclature & Identifiers
4.1 IUPAC Name
2,3,5-triiodobenzoic acid
4.2 InChI
InChI=1S/C7H3I3O2/c8-3-1-4(7(11)12)6(10)5(9)2-3/h1-2H,(H,11,12)
4.3 InChIKey
ZMZGFLUUZLELNE-UHFFFAOYSA-N
4.4 Canonical SMILES
C1=C(C=C(C(=C1C(=O)O)I)I)I
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
