The cas register number of Disperse Orange 73 is 40690-89-9. It also can be called as 4-(4-Nitrophenylazo)-N-(beta-benzoyloxyethyl)-N-(beta-cyanoethyl)aniline and the IUPAC Name about this chemical is 2-[N-(2-cyanoethyl)-4-[(4-nitrophenyl)diazenyl]anilino]ethyl benzoate. It belongs to the following product categories, such as Dyes and Pigments, Organics and so on.
Physical properties about Disperse Orange 73 are: (1)ACD/LogP: 6.13; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.13; (4)ACD/LogD (pH 7.4): 6.13; (5)#H bond acceptors: 9; (6)#Freely Rotating Bonds: 11; (7)Polar Surface Area: 123.87Å2; (8)Index of Refraction: 1.615; (9)Molar Refractivity: 125.39 cm3; (10)Molar Volume: 359.1 cm3; (11)Polarizability: 49.7x10-24cm3; (12)Surface Tension: 52.7 dyne/cm; (13)Flash Point: 360.3 °C; (14)Enthalpy of Vaporization: 98.73 kJ/mol; (15)Boiling Point: 672.1 °C at 760 mmHg; (16)Vapour Pressure: 6.35E-18 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=N(=O)c3ccc(N=Nc1ccc(cc1)N(CCC#N)CCOC(=O)c2ccccc2)cc3
(2)InChI: InChI=1/C24H21N5O4/c25-15-4-16-28(17-18-33-24(30)19-5-2-1-3-6-19)22-11-7-20(8-12-22)26-27-21-9-13-23(14-10-21)29(31)32/h1-3,5-14H,4,16-18H2
(3)InChIKey: SCLYXZFZPIKFAH-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C24H21N5O4/c25-15-4-16-28(17-18-33-24(30)19-5-2-1-3-6-19)22-11-7-20(8-12-22)26-27-21-9-13-23(14-10-21)29(31)32/h1-3,5-14H,4,16-18H2
(5)Std. InChIKey: SCLYXZFZPIKFAH-UHFFFAOYSA-N
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