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386704-06-9

Basic Information
CAS No.: 386704-06-9
Name: 2-CHLORO-6-(TRIFLUOROMETHYL)NICOTINONITRILE
Molecular Structure:
Molecular Structure of 386704-06-9 (2-CHLORO-6-(TRIFLUOROMETHYL)NICOTINONITRILE)
Formula: C7H2 Cl F3 N2
Molecular Weight: 206.554
Synonyms: 2-Chloro-6-(trifluoromethyl)-3-pyridinecarbonitrile;2-Chloro-6-trifluoromethylnicotinonitrile
Density: 1.51 g/cm3
Melting Point: 37-38°
Boiling Point: 235.1 ºC at 760 mmHg
Flash Point: 96 ºC
PSA: 36.68000
LogP: 2.62548
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  • 2-chloro-6-(trifluoromethyl)-3-pyridinecarbonitrile

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Chemistry

Empirical Formula: C7H2ClF3N2
Molecular Weight: 206.5524g/mol
Structure of 3-Pyridinecarbonitrile,2-chloro-6-(trifluoromethyl)- (CAS NO.386704-06-9):

Index of Refraction: 1.482
Molar Refractivity: 38.93 cm3
Molar Volume: 136.4 cm3
Polarizability: 15.43×10-24cm3
Surface Tension: 42.1 dyne/cm
Density: 1.51 g/cm3
Flash Point: 96 °C
Enthalpy of Vaporization: 47.19 kJ/mol
Boiling Point: 235.1 °C at 760 mmHg
Vapour Pressure: 0.0509 mmHg at 25°C 
Systematic Name: 2-chloro-6-(trifluoromethyl)pyridine-3-carbonitrile
SMILES: N#Cc1ccc(nc1Cl)C(F)(F)F
InChI: InChI=1/C7H2ClF3N2/c8-6-4(3-12)1-2-5(13-6)7(9,10)11/h1-2H
InChIKey: CDSFASYGONAHHN-UHFFFAOYAL