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Reference substances

Reference substances

Currently viewing:
IUPAC name:
tetrasodium 3,3'-({6-[(2-hydroxyethyl)amino]-1,3,5-triazine-2,4-diyl}bis[imino(2-methyl-4,1-phenylene)diazene-2,1-diyl])dinaphthalene-1,5-disulfonate

Inventory

EC number:
256-851-5
EC name:
Tetrasodium 3,3'-[[6-[(2-hydroxyethyl)amino]-1,3,5-triazine-2,4-diyl]bis[imino(2-methyl-4,1-phenylene)azo]]bisnaphthalene-1,5-disulphonate
CAS number:
50925-42-3
CAS number:
50925-42-3
Synonyms
Names:
1,5-Naphthalenedisulfonic acid, 3,3'-[[6-[(2-hydroxyethyl) amino]-1,3,5-triazine-2,4-diyl]bis[imino(2-methyl -4,1-phenylene)azo]]bis-, tetrasodium salt
Identifier:
IUPAC name
1,​5-​Naphthalenedisulfoni​c acid, 3,​3'-​[[6-​[(2-​hydroxyethyl)​amino]​-​1,​3,​5-​triazine-​2,​4-​diyl]​bis[imino(2-​methyl-​4,​1-​phenylene)​-​2,​1-​diazenediyl]​]​bis-​, sodium salt (1:4)
Identifier:
IUPAC name
sodium 3,3'-(1E,1'E)-(4,4'-(6-(2-hydroxyethylamino)-1,3,5-triazine-2,4-diyl)bis(azanediyl)bis(2-methyl-4,1-phenylene))bis(diazene-2,1-diyl)dinaphthalene-1,5-disulfonate
Identifier:
IUPAC name
tetrasodium 3,3'-[[6-[(2-hydroxyethyl)amino]-1,3,5-triazine-2,4-diyl]bis[imino(2-methyl-4,1-phenylene)azo]]bisnaphthalene-1,5-disulphonate
Identifier:
other: Molecular formula
C39H30N10O13S4.4Na
Identifier:
other: Molecular formula
C39H34N10O13S4.4Na

Molecular and structural information

Molecular formula:
C39H30N10Na4O13S4
Molecular weight:
1 066.934
SMILES notation:
[Na+].[Na+].[Na+].[Na+].[O-]S(=O)(=O)c7cccc1c7cc(cc1S([O-])(=O)=O)N=Nc2ccc(cc2C)Nc3nc(nc(NCCO)n3)Nc6cc(C)c(N=Nc5cc4c(cccc4c(c5)S([O-])(=O)=O)S([O-])(=O)=O)cc6
InChl:
InChI=1/C39H34N10O13S4.4Na/c1-21-15-23(9-11-31(21)48-46-25-17-29-27(35(19-25)65(57,58)59)5-3-7-33(29)63(51,52)53)41-38-43-37(40-13-14-50)44-39(45-38)42-24-10-12-32(22(2)16-24)49-47-26-18-30-28(36(20-26)66(60,61)62)6-4-8-34(30)64(54,55)56;;;;/h3-12,15-20,50H,13-14H2,1-2H3,(H,51,52,53)(H,54,55,56)(H,57,58,59)(H,60,61,62)(H3,40,41,42,43,44,45);;;;/q;4*+1/p-4
Structural formula:
Chemical structure

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