1-(2-Chloro-6-fluorophenyl)cyclohexanecarbonitrile

Base Information

• Chemical Name: 1-(2-Chloro-6-fluorophenyl)cyclohexanecarbonitrile
• CAS No.: 214262-95-0
• Molecular Formula: C13H13ClFN
• Molecular Weight: 237.7004
• DSSTox Substance ID: DTXSID60361462
• Wikidata: Q82143801
• Mol file: 214262-95-0.mol

Synonyms:1-(2-CHLORO-6-FLUOROPHENYL)CYCLOHEXANECARBONITRILE;214262-95-0;1-(2-chloro-6-fluorophenyl)cyclohexane-1-carbonitrile;SCHEMBL1019662;DTXSID60361462

Chemical Property of 1-(2-Chloro-6-fluorophenyl)cyclohexanecarbonitrile

Chemical Property:

• Vapor Pressure: 3.37E-05mmHg at 25°C
• Melting Point: 76oC
• Boiling Point: 354.4°Cat760mmHg
• Flash Point: 168.1°C
• PSA: 23.79000
• Density: 1.21g/cm³
• LogP: 4.20458
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 237.0720553
• Heavy Atom Count: 16
• Complexity: 290

Purity/Quality:

99.90% ^*data from raw suppliers

1-(2-CHLORO-6-FLUOROPHENYL)CYCLOHEXANECARBONITRILE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)(C#N)C2=C(C=CC=C2Cl)F