98730-04-2
| Name | Benoxacor |
| CAS | 98730-04-2 |
| EINECS(EC#) | 619-372-6 |
| Molecular Formula | C10H6Cl2N2 |
| MDL Number | MFCD00754193 |
| Molecular Weight | 225.07 |
| MOL File | 98730-04-2.mol |
Chemical Properties
| Melting point | 105-107° |
| Boiling point | 240°C (rough estimate) |
| density | 1.3416 (rough estimate) |
| vapor pressure | 0.002Pa at 25℃ |
| refractive index | 1.6070 (estimate) |
| Fp | >107 °C |
| storage temp. | 0-6°C |
| solubility | Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly) |
| form | neat |
| pka | 1.20±0.40(Predicted) |
| color | Pale Brown to Light Brown |
| Water Solubility | 38mg/L at 25℃ |
| BRN | 4190275 |
| Henry's Law Constant | 1.3×102 mol/(m3Pa) at 25℃, Duchowicz et al. (2020) |
| Major Application | agriculture environmental |
| InChI | 1S/C11H11Cl2NO2/c1-7-6-16-9-5-3-2-4-8(9)14(7)11(15)10(12)13/h2-5,7,10H,6H2,1H3 |
| InChIKey | PFJJMJDEVDLPNE-UHFFFAOYSA-N |
| SMILES | CC1COc2ccccc2N1C(=O)C(Cl)Cl |
| LogP | 2.6 at 25℃ |
Safety Data
| Symbol(GHS) |   GHS07,GHS09 |
| Signal word | Warning |
| Hazard statements | H317-H410 |
| Precautionary statements | P261-P272-P273-P280-P302+P352-P333+P313 |
| WGK Germany | 2 |
| RTECS | DM3029000 |
| TSCA | TSCA listed |
| REACH Registrations | Active |
| HS Code | 29349990 |
| Storage Class | 13 - Non Combustible Solids |
| Hazard Classifications | Aquatic Chronic 1 Skin Sens. 1 |
| Toxicity |