1. Primary Information
| English name: | Chloramben |
| CAS No.: | 133-90-4 |
| Molecular formula: | C7H5Cl2NO2 |
| Molecular weight: | 206.02 g/mol |
| SMILES: | C1=C(C=C(C(=C1C(=O)O)Cl)N)Cl |
| Structural class: | |
| Other identifiers: |
Amiben Amiben, aluminum salt Amiben, ammonium salt Amiben, monopotassium salt Amiben, sodium salt |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 5ml | - | 744 | 2-8°C | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
4. International Nomenclature & Identifiers
4.1 IUPAC Name
3-amino-2,5-dichlorobenzoic acid
4.2 InChI
InChI=1S/C7H5Cl2NO2/c8-3-1-4(7(11)12)6(9)5(10)2-3/h1-2H,10H2,(H,11,12)
4.3 InChIKey
HSSBORCLYSCBJR-UHFFFAOYSA-N
4.4 Canonical SMILES
C1=C(C=C(C(=C1C(=O)O)Cl)N)Cl
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
