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CAS No.: 256431-72-8
Name: (E)-3-[2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-2-propenenitrile
Article Data: 3
Molecular Structure:
Molecular Structure of 256431-72-8 ((E)-3-[2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-2-propenenitrile)
Formula: C21H15FN2
Molecular Weight: 314.362
Synonyms: (2E)-3-[2-Cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]acrylonitrile;
EINECS: 607-769-7
Density: 1.264 g/cm3
Boiling Point: 494.251 °C at 760 mmHg
Flash Point: 252.714 °C
Appearance: white powder
PSA: 36.68000
LogP: 5.45508
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Molecular Structure of (E)-3-[2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-2-propenenitrile (CAS NO.256431-72-8):

Molecular Formula: C21H15FN2
Molecular Weight of (E)-3-[2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-2-propenenitrile (CAS NO.256431-72-8): 314.3556
CAS NO: 256431-72-8 
Index of Refraction: 1.686
Molar Refractivity: 94.602 cm3
Molar Volume: 248.616 cm3
Surface Tension: 57.035 dyne/cm
Density: 1.264 g/cm3
Flash Point: 252.714 °C
Enthalpy of Vaporization: 76.156 kJ/mol
Boiling Point of (E)-3-[2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-2-propenenitrile (CAS NO.256431-72-8): 494.251 °C at 760 mmHg 
Systematic Name: (2E)-3-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]prop-2-enenitrile
SMILES: Fc4ccc(c1c3ccccc3nc(c1\C=C\C#N)C2CC2)cc4 
InChI: InChI=1/C21H15FN2/c22-16-11-9-14(10-12-16)20-17-4-1-2-6-19(17)24-21(15-7-8-15)18(20)5-3-13-23/h1-6,9-12,15H,7-8H2/b5-3+ 
InChIKey: BFDPBLWCXIOOLM-HWKANZROBW
Std. InChI: InChI=1S/C21H15FN2/c22-16-11-9-14(10-12-16)20-17-4-1-2-6-19(17)24-21(15-7-8-15)18(20)5-3-13-23/h1-6,9-12,15H,7-8H2/b5-3+ 
Std. InChIKey: BFDPBLWCXIOOLM-HWKANZROSA-N