| Identification | More | [Name]
(4-CHLORO-3-FLUORO-PHENYL)-ACETONITRILE | [CAS]
251570-03-3 | [Synonyms]
4-CHLORO-3-FLUOROBENZYLCYANIDE
3-FLUORO-4-CHLOROBENZYL CYANIDE
3-FLUORO-4-CHLORO PHENYLACETONITRILE
4-CHLORO-3-FLUOROPHHENYLACETONITRILE
2-(4-chloro-3-fluorophenyl)acetonitrile
(4-CHLORO-3-FLUORO-PHENYL)-ACETONITRILE
Benzeneacetonitrile, 4-chloro-3-fluoro-
3-Fluoro-4-Chloro Phenylacetonitrile 3-Fluoro-4-Chlorobenzyl Cyanide | [Molecular Formula]
C8H5ClFN | [MDL Number]
MFCD04115860 | [Molecular Weight]
169.58 | [MOL File]
251570-03-3.mol |
| Safety Data | Back Directory | [Symbol(GHS) ]
GHS07 | [Signal word ]
Warning | [Hazard statements ]
H315-H319 | [Precautionary statements ]
P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313 | [Hazard Codes ]
T | [Risk Statements ]
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection . | [RIDADR ]
3276 | [Hazard Note ]
Toxic | [HS Code ]
2926907090 |
| Hazard Information | Back Directory | [Chemical Properties]
Pale yellow liquid | [Synthesis]
Step 1: Potassium cyanide (KCN, 1.25 g, 19.2 mmol) was added to a solution of 3-fluoro-4-chlorobenzyl bromide (4-(bromomethyl)-1-chloro-2-fluorobenzene, 3.90 g, 17.5 mmol) in dimethyl sulfoxide (DMSO, 60 mL). A small amount of water (H2O, a few mL) was added to promote the dissolution of potassium cyanide. After 1 h of reaction, the reaction mixture was diluted with water and extracted with ethyl acetate (EtOAc). The organic phases were combined, dried over anhydrous sodium sulfate (Na2SO4), filtered and concentrated. The crude product was purified by silica gel fast column chromatography (Biotage 40M, eluent ratio 9:1 petroleum ether/ethyl acetate) to give 3-fluoro-4-chlorophenylacetonitrile (2-(4-chloro-3-fluorophenyl)acetonitrile, 1.81 g, yield 61.2%) as a yellow crystalline solid. | [References]
[1] Patent: WO2008/6040, 2008, A1. Location in patent: Page/Page column 114 |
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