Bifenox
- Product NameBifenox
- CAS42576-02-3
- MFC14H9Cl2NO5
- MW342.13
- EINECS255-894-7
- MOL File42576-02-3.mol
Chemical Properties
| Melting point | 84-86° |
| Boiling point | 421.0±45.0 °C(Predicted) |
| Density | 1.5715 (rough estimate) |
| refractive index | 1.7350 (estimate) |
| storage temp. | Keep in dark place,Sealed in dry,Room Temperature |
| solubility | Chloroform (Slightly), Ethyl Acetate (Slightly) |
| Appearance | Off-white to light yellow Solid |
| Water Solubility | 0.5mg/L(temperature not stated) |
| Merck | 13,1214 |
| BRN | 2170169 |
| Henry's Law Constant | 9.1×101 mol/(m3Pa) at 25℃, Duchowicz et al. (2020) |
| Major Application | agriculture environmental |
| InChI | 1S/C14H9Cl2NO5/c1-21-14(18)10-7-9(3-4-12(10)17(19)20)22-13-5-2-8(15)6-11(13)16/h2-7H,1H3 |
| InChIKey | SUSRORUBZHMPCO-UHFFFAOYSA-N |
| SMILES | COC(=O)c1cc(Oc2ccc(Cl)cc2Cl)ccc1[N+]([O-])=O |
| LogP | 4.480 |
| CAS DataBase Reference | 42576-02-3(CAS DataBase Reference) |
| NIST Chemistry Reference | Methyl 5-(2,4-dichlorophenoxy)-2-nitrobenzoate(42576-02-3) |
Safety Information
| Hazard Codes | N |
| Risk Statements | 50/53 |
| Safety Statements | 60-61 |
| RIDADR | UN 3077 9/PG 3 |
| WGK Germany | 2 |
| RTECS | DG7890000 |
| HS Code | 29189900 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Aquatic Acute 1 Aquatic Chronic 1 |
| Hazardous Substances Data | 42576-02-3(Hazardous Substances Data) |
| Toxicity | LD50 orally in rats, mice: >6400, 4556 mg/kg; LC50 in pheasants, wild ducks: >5000 ppm (Kruger) |
