2,6-Difluorobenzonitrile CAS 1897-52-5
Introduction：Basic information about 2,6-Difluorobenzonitrile CAS 1897-52-5, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
2,6-Difluorobenzonitrile Basic information
| Product Name: | 2,6-Difluorobenzonitrile |
| Synonyms: | 2,6-DIFLUOROBENZONIT;p-Phenylenediamine(1,4-Phenylenediamine);2,6-DIFLUOROBENZONITRILE, 97+%;2,6-DIFLUOROBENZNITRILE,97%;2,6-Difluorobenzonitrile99%;2,6-Difluoro carbonitrile;6-Difluorobenzonitrile;2,6-Difluorobenzonitrle |
| CAS: | 1897-52-5 |
| MF: | C7H3F2N |
| MW: | 139.1 |
| EINECS: | 217-589-7 |
| Product Categories: | C6 to C7;Cyanides/Nitriles;Nitrogen Compounds;Aromatic Nitriles;Fluorobenzene;Nitrile;Fluorine series;OLED |
| Mol File: | 1897-52-5.mol |
2,6-Difluorobenzonitrile Chemical Properties
| Melting point | 25-28 °C (lit.) |
| Boiling point | 197-198 °C |
| density | 1.246 g/mL at 25 °C (lit.) |
| vapor pressure | 18Pa at 20℃ |
| refractive index | n |
| Fp | 176 °F |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | DMSO (Slightly), Methanol (Slightly) |
| form | Solid |
| color | Off-White |
| Odor | Almond-like odor |
| Water Solubility | 1.87g/L at 19.85℃ |
| BRN | 2045292 |
| InChI | 1S/C7H3F2N/c8-6-2-1-3-7(9)5(6)4-10/h1-3H |
| InChIKey | BNBRIFIJRKJGEI-UHFFFAOYSA-N |
| SMILES | Fc1cccc(F)c1C#N |
| LogP | 1.9 |
| CAS DataBase Reference | 1897-52-5(CAS DataBase Reference) |
| NIST Chemistry Reference | Benzonitrile, 2,6-difluoro-(1897-52-5) |
| EPA Substance Registry System | Benzonitrile, 2,6-difluoro- (1897-52-5) |
Safety Information
| Hazard Codes | Xn,T,Xi |
| Risk Statements | 20/21/22-36/37/38 |
| Safety Statements | 26-36-36/37/39 |
| RIDADR | 3439 |
| WGK Germany | 3 |
| Hazard Note | Toxic |
| TSCA | TSCA listed |
| HazardClass | 6.1 |
| PackingGroup | III |
| HS Code | 29269095 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
| Chemical Properties | white to light yellow crystal powder |
| Uses | 2,6-Difluorobenzonitrile was used in the synthesis of:
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| Uses | 2,6-Difluorobenzonitrile is a halogenated benzonitrile with fungacidal activity. 2,6-Difluorobenzonitrile is the difluoro analogue of the herbicide Dichlobenil. |
| Flammability and Explosibility | Non flammable |
| Synthesis | 2,6-Difluorobenzonitrile [1897-52-5], 1- cyano-2,6-difluorobenzene, Mr 172.02, mp 29 – 30℃, forms colorless crystals. The nitrile can be produced by treatment of 2,6-dichlorobenzonitrile with potassium fluoride in sulfolane and is used as an intermediate in the synthesis of insecticides (e.g., Dimilin, Shell). |
| Toxics Screening Level | The initial threshold screening level (ITSL) for 2,6-difluorobenzonitrile (DFBN) is 0.2 μg/m3 based on an annual averaging time. |
2,6-Difluorobenzonitrile Preparation Products And Raw materials
| Raw materials | Potassium fluoride-->Gamma Butyrolactone-->Sulfolane-->2,6-Dichlorobenzonitrile-->3-CHLORO-2,6-DIFLUOROBENZONITRILE-->2,6-DIFLUOROBENZALDEHYDE OXIME-->2,6-Difluorobenzylamine-->tetrakis(N,N-DIethylaMino)phosphorus broMide |
| Preparation Products | Chlorfluazuron-->2,6-Difluorobenzamide-->Diflubenzuron-->3-Bromo-2,6-difluorobenzonitrile-->3-Bromo-2,6-difluorobenzamide-->5-tert-butoxyquinazoline-2,4-diaMine-->tasquinimod-->2-amino-6-bromobenzonitrile-->2-FLUORO-6-(4-METHYLPHENOXY)BENZONITRILE-->2-FLUORO-6-(4-METHYLBENZYLOXY)BENZONITRILE-->2,6-Difluorobenzoyl isocyanate-->Benzonitrile, 2-fluoro-6-(phenylthio)- |
