Product Name

  • Name

    2-CHLORO-6-(4-FLUOROPHENYL)NICOTINONITRILE

  • EINECS
  • CAS No. 31776-83-7
  • Article Data3
  • CAS DataBase
  • Density 1.37g/cm3
  • Solubility
  • Melting Point 173-176°C
  • Formula C12H6 Cl F N2
  • Boiling Point 373.3°Cat760mmHg
  • Molecular Weight 232.644
  • Flash Point 179.5°C
  • Transport Information
  • Appearance
  • Safety
    Hazard Codes Xi
    Risk Statements 20/21/22-36/37/38
    Safety Statements 26-36/37/39
    RIDADR 3439
    Hazard Note Irritant
    HazardClass 6.1
    PackingGroup III
  • Risk Codes 20/21/22-36/37/38
  • Molecular Structure Molecular Structure of 31776-83-7 (2-CHLORO-6-(4-FLUOROPHENYL)NICOTINONITRILE)
  • Hazard Symbols
  • Synonyms Nicotinonitrile,2-chloro-6-(p-fluorophenyl)- (8CI);2-Chloro-6-(4-fluorophenyl)pyridin-3-nitrile
  • PSA
  • LogP

2-Chloro-6-(4-fluorophenyl)nicotinonitrile Chemical Properties

Molecular structure of 2-Chloro-6-(4-fluorophenyl)nicotinonitrile (CAS NO.31776-83-7) is:

Product Name: 2-Chloro-6-(4-fluorophenyl)nicotinonitrile
CAS Registry Number: 31776-83-7
IUPAC Name: 2-Chloro-6-(4-fluorophenyl)pyridine-3-carbonitrile
Molecular Weight: 232.640843 [g/mol]
Molecular Formula: C12H6ClFN2
XLogP3-AA: 3.3
H-Bond Donor: 0
H-Bond Acceptor: 3
Melting Point: 173-176 °C
Index of Refraction: 1.612
Molar Refractivity: 58.76 cm3
Molar Volume: 168.9 cm3
Surface Tension: 57.4 dyne/cm
Density: 1.37 g/cm3
Flash Point: 179.5 °C
Enthalpy of Vaporization: 62.05 kJ/mol
Boiling Point: 373.3 °C at 760 mmHg
Vapour Pressure: 9.07E-06 mmHg at 25 °C 
Canonical SMILES: C1=CC(=CC=C1C2=NC(=C(C=C2)C#N)Cl)F
InChI: InChI=1S/C12H6ClFN2/c13-12-9(7-15)3-6-11(16-12)8-1-4-10(14)5-2-8/h1-6H
InChIKey: VJYNNRPTVYPCCS-UHFFFAOYSA-N

2-Chloro-6-(4-fluorophenyl)nicotinonitrile Safety Profile

Safty information about 2-Chloro-6-(4-fluorophenyl)nicotinonitrile (CAS NO.31776-83-7) is:
Hazard Codes: IrritantXi
Risk Statements 20/21/22-36/37/38 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed. 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements 26-36/37/39 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
RIDADR: 3439
Hazard Note: Irritant
HazardClass: 6.1
PackingGroup: III

2-Chloro-6-(4-fluorophenyl)nicotinonitrile Specification

 2-Chloro-6-(4-fluorophenyl)nicotinonitrile , its cas register number is 31776-83-7. It also can be called 3-Pyridinecarbonitrile,2-chloro-6-(4-fluorophenyl)- .

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