Acid Yellow 220 (71603-79-7)

The Acid yellow 220 (C.I. 11714), with the cas registry number 71603-79-7, has its systematic name of cobalt(2+) sodium 2-[({3-[(2Z)-2-{1-[(2-chlorophenyl)carboximidato]-2-oxopropylidene}hydrazinyl]-4-oxidophenyl}sulfonyl)amino]benzoate (1:4:2). And its product categories are including Dyes and Pigments.

The characteristics of this chemical are as follows: (1)ACD/LogP: 4.62; (2)# of Rule of 5 Violations: 3; (3)#H bond acceptors: 11; (4)#H bond donors: 5; (5)#Freely Rotating Bonds: 9; (6)Polar Surface Area: 168.55; (7)Flash Point: 417.6 °C; (8)Enthalpy of Vaporization: 117.15 kJ/mol; (9)Boiling Point: 766.9 °C at 760 mmHg; (10)Vapour Pressure: 9.86E-25 mmHg at 25°C; (11)Exact Mass: 1204.977923; (12)MonoIsotopic Mass: 1204.977923; (13)Topological Polar Surface Area: 389; (14)Heavy Atom Count: 77; (15)Formal Charge: 0; (16)Complexity: 963.

You could obtain the molecular structure by converting the following datas:
(1)SMILES:[Co+2].[Na+].[Na+].[Na+].[Na+].[O-]C(=O)c1ccccc1NS(=O)(=O)c2cc(c([O-])cc2)N\N=C(/C(=O)C)C(/[O-])=N/c3ccccc3Cl.Clc3ccccc3/N=C(/[O-])\C(=N\Nc1cc(ccc1[O-])S(=O)(=O)Nc2ccccc2C([O-])=O)C(=O)C
(2)InChI:InChI=1/2C23H19ClN4O7S.Co.4Na/c2*1-13(29)21(22(31)25-18-9-5-3-7-16(18)24)27-26-19-12-14(10-11-20(19)30)36(34,35)28-17-8-4-2-6-15(17)23(32)33;;;;;/h2*2-12,26,28,30H,1H3,(H,25,31)(H,32,33);;;;;/q;;+2;4*+1/p-6/b2*27-21+;;;;;
(3)InChIKey:IEZWQSSKUNSCBD-JAMTZZTIBJ