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General information

Inventory

EC number:
237-600-9
EC name:
Disodium 4,4'-bis[[6-anilino-4-[(2-hydroxyethyl)methylamino]-1,3,5-triazin-2-yl]amino]stilbene-2,2'-disulphonate
CAS number:
13863-31-5

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Reference substance information

IUPAC name:
disodium 5-({4-[(2-hydroxyethyl)(methyl)amino]-6-(phenylamino)-1,3,5-triazin-2-yl}amino)-2-[(E)-2-[4-({4-[(2-hydroxyethyl)(methyl)amino]-6-(phenylamino)-1,3,5-triazin-2-yl}amino)-2-sulfonatophenyl]ethenyl]benzene-1-sulfonate
Synonyms
Names:
Benzenesulfonic acid, 2,2'-(1,2-ethenediyl)bis[ 5-[[4-[(2-hydroxyethyl)methylamino]-6-(phenylamino )-1,3,5-triazin-2-yl]amino]-, disodium salt
Benzenesulfonic acid, 2,2'-(1,2-ethenediyl)bis[5-[[4-[(2-hydroxyethyl)methylamino]-6-(phenylamino)-1,3,5-triazin-2-yl]amino]-, disodium salt
Tinopal 5BM-GX molecule
Identifier:
CAS number
13863-31-5
disodium 2,2'-ethene-1,2-diylbis[5-({4-anilino-6-[(2-hydroxyethyl)(methyl)amino]-1,3,5-triazin-2-yl}amino)benzenesulfonate]

CAS information

CAS number:
13863-31-5

Molecular and structural information

Molecular formula:
C38H40N12O8S2.2Na
Molecular weight:
900.894
SMILES notation:
[Na+].[Na+].CN(CCO)c1nc(Nc2ccccc2)nc(Nc3ccc(\C=C\c4ccc(Nc5nc(Nc6ccccc6)nc(n5)N(C)CCO)cc4S(=O)(=O)[O-])c(c3)S(=O)(=O)[O-])n1
InChl:
InChI=1/C38H40N12O8S2.2Na/c1-49(19-21-51)37-45-33(39-27-9-5-3-6-10-27)43-35(47-37)41-29-17-15-25(31(23-29)59(53,54)55)13-14-26-16-18-30(24-32(26)60(56,57)58)42-36-44-34(40-28-11-7-4-8-12-28)46-38(48-36)50(2)20-22-52;;/h3-18,23-24,51-52H,19-22H2,1-2H3,(H,53,54,55)(H,56,57,58)(H2,39,41,43,45,47)(H2,40,42,44,46,48);;/q;2*+1/p-2
Structural formula:
Chemical structure