102407

4-Fluorophenylacetonitrile

99%

• Synonym(s): 4-Fluorobenzyl cyanide
• Linear Formula: FC₆H₄CH₂CN
• CAS Number: 459-22-3
• Molecular Weight: 135.14
• NACRES: NA.22
• PubChem Substance ID: 24846576
• UNSPSC Code: 12352100
• EC Number: 207-286-8
• MDL number: MFCD00001917
• Assay: 99%

Properties

• Quality Segment: 100
• assay: 99%
• refractive index: n20/D 1.5002 (lit.)
• bp: 119-120 °C/18 mmHg (lit.)
• density: 1.126 g/mL at 25 °C (lit.)
• functional group: fluoro, nitrile
• SMILES string: Fc1ccc(CC#N)cc1
• InChI: 1S/C8H6FN/c9-8-3-1-7(2-4-8)5-6-10/h1-4H,5H2
• InChI key: JHQBLYITVCBGTO-UHFFFAOYSA-N

Description

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.

Safety Information

• pictograms: GHS07
• signalword: Warning
• hcodes: H302 + H312 + H332,H315,H319,H335
• pcodes: P261 - P280 - P301 + P312 - P302 + P352 + P312 - P304 + P340 + P312 - P305 + P351 + P338
• Hazard Classifications: Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• target_organs: Respiratory system
• Storage Class: 6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
• wgk: WGK 3
• flash_point_f: 226.4 °F - closed cup
• flash_point_c: 108 °C - closed cup
• ppe: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter