The Pigment red 48:2, with the CAS registry number 7023-61-2 and EINECS registry number 230-303-5, has the systematic name of calcium calcium 4-(5-chloro-4-methyl-2-sulfonato-phenyl)azo-3-hydroxy-naphthalene-2-carboxylate. It belongs to the following product categories: Dyes and Pigments; Organics. And the molecular formula of the chemical is C18H11CaClN2O6S.
The physical properties of Pigment red 48:2 are as followings: (1)#H bond acceptors: 8; (2)#H bond donors: 3; (3)#Freely Rotating Bonds: 5; (4)Polar Surface Area: 150.66 Å2.
You can still convert the following datas into molecular structure:
(1)SMILES: [Ca+2].Cc1cc(c(cc1Cl)N=Nc2c3ccccc3cc(C([O-])=O)c2O)S([O-])(=O)=O
(2)InChI: InChI=1/C18H13ClN2O6S.Ca/c1-9-6-15(28(25,26)27)14(8-13(9)19)20-21-16-11-5-3-2-4-10(11)7-12(17(16)22)18(23)24;/h2-8,22H,1H3,(H,23,24)(H,25,26,27);/q;+2/p-2
(3)InChIKey: KCAQGUXPIKJXTQ-NUQVWONBAC
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