Molecular Structure of Solvent Red 179 (CAS NO.6829-22-7):
Empirical Formula: C22H12N2O
Molecular Weight: 320.3435
H bond acceptors: 3
H bond donors: 0
Freely Rotating Bonds: 0
Polar Surface Area: 32.67 Å2
Index of Refraction: 1.787
Molar Refractivity: 96.5 cm3
Molar Volume: 228.3 cm3
Surface Tension: 59.6 dyne/cm
Density: 1.4 g/cm3
Flash Point: 323.7 °C
Enthalpy of Vaporization: 90.81 kJ/mol
Boiling Point: 611.6 °C at 760 mmHg
Vapour Pressure: 6.73E-15 mmHg at 25°C
EINECS: 229-904-5
InChI
InChI=1/C22H12N2O/c25-22-16-10-2-6-13-5-1-9-15(19(13)16)21-23-17-11-3-7-14-8-4-12-18(20(14)17)24(21)22/h1-12H
Smiles
O=c1n2c3c4c(cccc4nc2c2c4c(cccc14)ccc2)ccc3
Solvent Red 179 , with CAS number of 6829-22-7, can be called 14H-Perimidino[2,1-a]benz[de]isoquinolin-14-one ; Amaplast Red RP ; 14H-benz[4,5]isoquino[2,1-a]perimidin-14-one ; C.I. Solvent Red 179 ; Kayaset Red A 2G ; LumaplastRed A 2G ; Macrolex Red E 2G ; Naphthaloperinone ; Plast Red 8370 ; Sandoplast Red2G .
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