IUPAC Name: 4-Isoquinolin-8-yldiazenyl-N,N-dimethylaniline
Synonyms of 7-((p-(Dimethylamino)phenyl)azo)isoquinoline (CAS NO.63040-65-3): N,N-Dimethyl-4-(7'-isoquinolinylazo)aniline ; Isoquinoline, 7-((p-(dimethylamino)phenyl)azo)-
CAS NO: 63040-65-3
Molecular Formula: C17H16N4
Molecular Weight: 276.3357
Molecular Structure:
H bond acceptors: 4
H bond donors: 0
Freely Rotating Bonds: 3
Polar Surface Area: 40.85 Å2
Index of Refraction: 1.622
Molar Refractivity: 85.99 cm3
Molar Volume: 243.9 cm3
Surface Tension: 43 dyne/cm
Density: 1.13 g/cm3
Flash Point: 246 °C
Enthalpy of Vaporization: 74.81 kJ/mol
Boiling Point: 483.1 °C at 760 mmHg
Vapour Pressure: 1.72E-09 mmHg at 25°C
InChI: InChI=1/C17H16N4/c1-21(2)15-8-6-14(7-9-15)19-20-17-5-3-4-13-10-11-18-12-16(13)17/h3-12H,1-2H3/b20-19+
InChIKey: JQYCSQZBMSRMJX-FMQUCBEEBW
Std. InChI: InChI=1S/C17H16N4/c1-21(2)15-8-6-14(7-9-15)19-20-17-5-3-4-13-10-11-18-12-16(13)17/h3-12H,1-2H3/b20-19+
Std. InChIKey: JQYCSQZBMSRMJX-FMQUCBEESA-N
Questionable carcinogen with experimental tumorigenic data. When 7-((p-(Dimethylamino)phenyl)azo)isoquinoline (CAS NO.63040-65-3) is heated to decomposition, it emits toxic fumes of NOx.
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