2,3,5-Trifluorophenylacetonitrile

Base Information

• Chemical Name: 2,3,5-Trifluorophenylacetonitrile
• CAS No.: 243666-14-0
• Molecular Formula: C8H4F3N
• Molecular Weight: 171.12
• Hs Code.: 2926909090
• European Community (EC) Number: 671-575-9
• DSSTox Substance ID: DTXSID50380728
• Wikidata: Q72513230
• Mol file: 243666-14-0.mol

Synonyms:2,3,5-Trifluorophenylacetonitrile;243666-14-0;2-(2,3,5-trifluorophenyl)acetonitrile;2,3,5-Trifluorobenzyl cyanide;(2,3,5-Trifluorophenyl)acetonitrile;Benzeneacetonitrile,2,3,5-trifluoro-;SCHEMBL7100610;DTXSID50380728;MFCD00083546;AKOS006229589;AC-4197;AM62523;JS-4107;A5024;CS-0207390;FT-0653262

Chemical Property of 2,3,5-Trifluorophenylacetonitrile

Chemical Property:

• Vapor Pressure: 0.242mmHg at 25°C
• Refractive Index: 1.468
• Boiling Point: 206.044 °C at 760 mmHg
• Flash Point: 78.413 °C
• PSA: 23.79000
• Density: 1.334 g/cm³
• LogP: 2.16998
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 171.02958362
• Heavy Atom Count: 12
• Complexity: 198

Purity/Quality:

99% ^*data from raw suppliers

2,3,5-Trifluorophenylacetonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=C(C(=C1CC#N)F)F)F