[μ-[[2,2'-(1,2-乙二烯基)双 [5-[[5-羟基-4-[(2-羟基-5-磺苯基) 偶氮]-2-甲氧苯基]氧化偶氮基]苯磺酸基合]](8-)]]二铜酸盐(4-)四钠

copper, (u-(tetrahydrogen 4,4'-bis((5-hydroxy-4-((2-hydroxy-5-sulfophenyl)azo)-2-methoxyphenyl)azoxy-2,2'-stilbenedisulfonato(4-)))di-, tetrasodium salt · CAS 70304-40-4

中文名: [μ-[[2,2'-(1,2-乙二烯基)双 [5-[[5-羟基-4-[(2-羟基-5-磺苯基) 偶氮]-2-甲氧苯基]氧化偶氮基]苯磺酸基合]](8-)]]二铜酸盐(4-)四钠
中文别名: 暂无
英文名: copper, (u-(tetrahydrogen 4,4'-bis((5-hydroxy-4-((2-hydroxy-5-sulfophenyl)azo)-2-methoxyphenyl)azoxy-2,2'-stilbenedisulfonato(4-)))di-, tetrasodium salt
CAS: 70304-40-4
CID: 136180144
IUPAC 名称: tetrasodium;copper;[5-hydroxy-4-[(2-hydroxy-5-sulfophenyl)diazenyl]-2-methoxyphenyl]imino-[2-[(E)-2-[2-[[5-hydroxy-4-[(2-hydroxy-5-sulfophenyl)diazenyl]-2-methoxyphenyl]imino-oxidoazaniumyl]-4-sulfophenyl]ethenyl]-5-sulfophenyl]-oxidoazanium

名称与编号

中文名: [μ-[[2,2'-(1,2-乙二烯基)双 [5-[[5-羟基-4-[(2-羟基-5-磺苯基) 偶氮]-2-甲氧苯基]氧化偶氮基]苯磺酸基合]](8-)]]二铜酸盐(4-)四钠
中文别名: 暂无
英文名: copper, (u-(tetrahydrogen 4,4'-bis((5-hydroxy-4-((2-hydroxy-5-sulfophenyl)azo)-2-methoxyphenyl)azoxy-2,2'-stilbenedisulfonato(4-)))di-, tetrasodium salt
CAS: 70304-40-4
CID: 136180144
IUPAC 名称: tetrasodium;copper;[5-hydroxy-4-[(2-hydroxy-5-sulfophenyl)diazenyl]-2-methoxyphenyl]imino-[2-[(E)-2-[2-[[5-hydroxy-4-[(2-hydroxy-5-sulfophenyl)diazenyl]-2-methoxyphenyl]imino-oxidoazaniumyl]-4-sulfophenyl]ethenyl]-5-sulfophenyl]-oxidoazanium

分子属性

分子式: C40H32Cu2N8Na4O20S4+4
分子量: 1292 g/mol
精确质量: 1289.879841 Da
单同位素质量: 1289.879841 Da
XLogP: 暂无
极性表面积: 482 Å²
氢键供体: 8
氢键受体: 26
可旋转键: 4
重原子数: 78
净电荷: 4
结构复杂度: 2310

结构标识

InChIKey: AZSUSLNVVQFQMZ-TUXRZHMZSA-N
SMILES: COC1=CC(=C(C=C1N=[N+](C2=C(C=CC(=C2)S(=O)(=O)O)/C=C/C3=C(C=C(C=C3)S(=O)(=O)O)[N+](=NC4=CC(=C(C=C4OC)N=NC5=C(C=CC(=C5)S(=O)(=O)O)O)O)[O-])[O-])O)N=NC6=C(C=CC(=C6)S(=O)(=O)O)O.[Na+].[Na+].[Na+].[Na+].[Cu].[Cu]
InChI: InChI=1S/C40H32N8O20S4.2Cu.4Na/c1-67-39-19-29(43-41-27-13-23(69(55,56)57)9-11-35(27)49)37(51)17-31(39)45-47(53)33-15-25(71(61,62)63)7-5-21(33)3-4-22-6-8-26(72(64,65)66)16-34(22)48(54)46-32-18-38(52)30(20-40(32)68-2)44-42-28-14-24(70(58,59)60)10-12-36(28)50;;;;;;/h3-20,49-52H,1-2H3,(H,55,56,57)(H,58,59,60)(H,61,62,63)(H,64,65,66);;;;;;/q;;;4*+1/b4-3+,43-41?,44-42?,47-45?,48-46?;;;;;;