1. Primary Information
| English name: | Bromfenvinphos |
| CAS No.: | 33399-00-7 |
| Molecular formula: | C12H14BRCl2O4P |
| Molecular weight: | 404.02 g/mol |
| SMILES: | CCOP(=O)(OCC)OC(=CBr)C1=C(C=C(C=C1)Cl)Cl |
| Structural class: | |
| Other identifiers: |
2-bromo-1-(2,4-dichlorophenyl)vinyl-O,O-diethylphosphate bromfenvinphos bromfenvinphos, (E)-isomer bromfenvinphos, (Z)-isomer bromphenvinphos |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 1ml | 1000μg/ml in acetone | 312 | 2-8℃ | in stock | - |
| Kehua Intelligence | 1.2ml | 1000μg/ml in methanol(anhydrous) | 312 | 2-8℃ | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
4. International Nomenclature & Identifiers
4.1 IUPAC Name
[(E)-2-bromo-1-(2,4-dichlorophenyl)ethenyl] diethyl phosphate
4.2 InChI
InChI=1S/C12H14BrCl2O4P/c1-3-17-20(16,18-4-2)19-12(8-13)10-6-5-9(14)7-11(10)15/h5-8H,3-4H2,1-2H3/b12-8+
4.3 InChIKey
ORDKAVSHIKNMAN-XYOKQWHBSA-N
4.4 Canonical SMILES
CCOP(=O)(OCC)OC(=CBr)C1=C(C=C(C=C1)Cl)Cl
4.5 Isomeric SMILES
CCOP(=O)(OCC)O/C(=C/Br)/C1=C(C=C(C=C1)Cl)Cl
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
