Systematic Name: N,N-Dimethyl-4-[(E)-(1-oxidoquinolin-4-yl)diazenyl]aniline
Synonyms of N,N-Dimethyl-4-((4'-quinolyl-1'-oxide)-azo)aniline (CAS NO.63042-68-2): 4-((p-(Dimethylamino)phenyl)azo)quinoline 1-oxide ; Quinoline, 4-((p-(dimethylamino)phenyl)azo)-, 1-oxide
InChI: InChI=1/C17H16N4O/c1-20(2)14-9-7-13(8-10-14)18-19-16-11-12-21(22)17-6-4-3-5-15(16)17/h3-12H,1-2H3/b19-18+
InChIKey: IZZIWNFFQWGBME-VHEBQXMUBK
Std. InChI: InChI=1S/C17H16N4O/c1-20(2)14-9-7-13(8-10-14)18-19-16-11-12-21(22)17-6-4-3-5-15(16)17/h3-12H,1-2H3/b19-18+
Std. InChIKey: IZZIWNFFQWGBME-VHEBQXMUSA-N
CAS NO: 63042-68-2
Molecular Formula: C17H16N4O
Molecular Weight: 292.3351
Molecular Structure :
H bond acceptors: 5
H bond donors: 0
Freely Rotating Bonds: 3
Polar Surface Area: 52.07 Å2
Index of Refraction: 1.627
Molar Refractivity: 87.74 cm3
Molar Volume: 247.2 cm3
Surface Tension: 46.2 dyne/cm
Density: 1.18 g/cm3
Flash Point: 266.1 °C
Enthalpy of Vaporization: 78.86 kJ/mol
Boiling Point: 516.5 °C at 760 mmHg
Vapour Pressure: 8.97E-11 mmHg at 25°C
Questionable carcinogen with experimental tumorigenic data. When N,N-Dimethyl-4-((4'-quinolyl-1'-oxide)-azo)aniline (CAS NO.63042-68-2) is heated to decomposition, it emits toxic fumes of NOx.
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