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HomeProduct name list4-Fluorophenylacetonitrile

4-Fluorophenylacetonitrile

Synonym(s):4-Fluorobenzyl cyanide

  • CAS NO.:459-22-3
  • Empirical Formula: C8H6FN
  • Molecular Weight: 135.14
  • MDL number: MFCD00001917
  • EINECS: 207-286-8
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2024-08-21 22:41:43
4-Fluorophenylacetonitrile Structural

What is 4-Fluorophenylacetonitrile?

Chemical properties

Clear light yellow liquid

The Uses of 4-Fluorophenylacetonitrile

4-Fluorophenylacetonitrile is used as a reagent in the synthesis of novel Daidzein analogs which exhibit anti-influenza activity in vitro. It is also used as a reagent in the synthesis of benzylbenzo[d]thiazole sulfonamides which exhibit anti-inflammatory activity.

General Description

4-Fluorophenylacetonitrile is starting reagent in the synthesis of 1-Alkyl-N-[2-ethyl-2-(4-fluorophenyl)butyl]piperidine-4-carboxamide derivatives.

Biochem/physiol Actions

4-Fluorophenylacetonitrile undergoes biotransformation to 4-Fluorophenylacetic acid by marine fungi, Aspergillus sydowii Ce19.

Properties of 4-Fluorophenylacetonitrile

Melting point: 86°C
Boiling point: 119-120 °C/18 mmHg (lit.)
Density  1.126 g/mL at 25 °C (lit.)
refractive index  n20/D 1.5002(lit.)
Flash point: 227 °F
storage temp.  Inert atmosphere,Room Temperature
form  Liquid
color  Clear colorless to light yellow
BRN  1907764
Exposure limits NIOSH: IDLH 25 mg/m3
CAS DataBase Reference 459-22-3(CAS DataBase Reference)
NIST Chemistry Reference 4-Fluorophenylacetic acid nitrile(459-22-3)
EPA Substance Registry System Benzeneacetonitrile, 4-fluoro- (459-22-3)

Safety information for 4-Fluorophenylacetonitrile

Signal word Warning
Pictogram(s)
ghs
Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

Computed Descriptors for 4-Fluorophenylacetonitrile

InChIKey JHQBLYITVCBGTO-UHFFFAOYSA-N

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