3-Chloro-2-fluoro-6-(trifluoromethyl)phenylacetonitrile

Base Information

• Chemical Name: 3-Chloro-2-fluoro-6-(trifluoromethyl)phenylacetonitrile
• CAS No.: 261763-16-0
• Molecular Formula: C9H4ClF4N
• Molecular Weight: 237.584072
• Hs Code.: 2926909090
• DSSTox Substance ID: DTXSID90378705
• Wikidata: Q82168243
• Mol file: 261763-16-0.mol

Synonyms:3-Chloro-2-fluoro-6-(trifluoromethyl)phenylacetonitrile;261763-16-0;2-[3-chloro-2-fluoro-6-(trifluoromethyl)phenyl]acetonitrile;DTXSID90378705;WUGOTINVGOAFKL-UHFFFAOYSA-N;MFCD01631347;AKOS015890083;AC-4189;FT-0655341;A21806;(3-Chloro-2-fluoro-6-trifluoromethyl-phenyl)-acetonitrile

Chemical Property of 3-Chloro-2-fluoro-6-(trifluoromethyl)phenylacetonitrile

Chemical Property:

• Vapor Pressure: 0.0361mmHg at 25°C
• Refractive Index: 1.463
• Boiling Point: 241.4 °C at 760 mmHg
• Flash Point: 99.8 °C
• PSA: 23.79000
• Density: 1.437 g/cm³
• LogP: 3.56398
• Storage Temp.: 2-8°C
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 236.9968395
• Heavy Atom Count: 15
• Complexity: 269

Purity/Quality:

98%min ^*data from raw suppliers

3-Chloro-2-fluoro-6-(trifluoromethyl)phenylacetonitrile 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C(=C1C(F)(F)F)CC#N)F)Cl