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Reference substances

Reference substances

Currently viewing:
IUPAC name:
hexasodium 4,4'-[1,4-phenylenebis[imino(6-chloro-1,3,5-triazine-4,2-diyl)imino]]bis[5-hydroxy-6-[(2-sulphonatophenyl)azo]naphthalene-2,7-disulphonate]

Inventory

EC number:
269-284-3
EC name:
Hexasodium 4,4'-[1,4-phenylenebis[imino(6-chloro-1,3,5-triazine-4,2-diyl)imino]]bis[5-hydroxy-6-[(2-sulphonatophenyl)azo]naphthalene-2,7-disulphonate]
CAS number:
68214-04-0
CAS number:
68214-04-0
Synonyms
Names:
2,7-Naphthalenedisulfonic acid, 4,4'-[1,4-phenylenebis[imino( 6-chloro-1,3,5-triazine-4,2-diyl)imino]]bis[5 -hydroxy-6-[(2-sulfophenyl)azo]-, hexasodium salt
2,7-Naphthalenedisulfonic acid, 4,4'-[1,4-phenylenebis[imino(6-chloro-1,3,5-triazine-4,2-diyl)imino]]bis[5-hydroxy-6-[(2-sulfophenyl)azo]-, hexasodium salt
Identifier:
IUPAC name
2,​7-​Naphthalenedisulfoni​c acid, 4,​4'-​[1,​4-​phenylenebis[imino(6​-​chloro-​1,​3,​5-​triazine-​4,​2-​diyl)​imino]​]​bis[5-​hydroxy-​6-​[2-​(2-​sulfophenyl)​diazenyl]​-​, sodium salt (1:6)
Identifier:
IUPAC name
Hexasodium 5-[[4-chloro-6-[[4-[[4-chloro-6-[[8-hydroxy-3,6-disulfonato-7-[(2-sulfonatophenyl)diazenyl]naphthalen-1-yl]amino]-1,3,5-triazin-2-yl]amino]phenyl]amino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate
Identifier:
IUPAC name
Hexasodium 8-{[(2E)-6-chloro-4-[(4-{[(4Z)-6-chloro-4-({8-oxido-6-sulfo-3-sulfonato-7-[(E)-2-(2-sulfonatophenyl)diazen-1-yl]naphthalen-1-yl}imino)-4,5-dihydro-1,3,5-triazin-2-yl]amino}phenyl)amino]-1,2-dihydro-1,3,5-triazin-2-ylidene]amino}-3-sulfo-6-sulfonato-2-[(E)-2-(2-sulfonatophenyl)diazen-1-yl]naphthalen-1-olate
Identifier:
IUPAC name
hexasodium 4,4'-{1,4-phenylenebis[imino(6-chloro-1,3,5-triazine-4,2-diyl)imino]}bis{5-hydroxy-6-[(2-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate}
Identifier:
IUPAC name
hexasodium 8-{[(2E)-6-chloro-4-[(4-{[(4Z)-6-chloro-4-({8-oxido-6-sulfo-3-sulfonato-7-[(E)-2-(2-sulfonatophenyl)diazen-1-yl]naphthalen-1-yl}imino)-4,5-dihydro-1,3,5-triazin-2-yl]amino}phenyl)amino]-1,2-dihydro-1,3,5-triazin-2-ylidene]amino}-3-sulfo-6-sulfonato-2-[(E)-2-(2-sulfonatophenyl)diazen-1-yl]naphthalen-1-olate
Identifier:
common name
Rouge Cellusol 4GE
Identifier:
other: Molecular formula
C44H24Cl2N14Na6O20S6
Identifier:
other: Molecular formula
C44H24Cl2N14O20S6.6Na
Identifier:
other: Molecular formula
C44H30Cl2N14O20S6.6Na
Identifier:
other: InChl
nChI=1/C44H30Cl2N14O20S6.6Na/c45-39-51-41(55-43(53-39)49-27-17-23(81(63,64)65)13-19-15-31(85(75,76)77)35(37(61)33(19)27)59-57-25-5-1-3-7-29(25)83(69,70)71)47-21-9-11-22(12-10-21)48-42-52-40(46)54-44(56-42)50-28-18-24(82(66,67)68)14-20-16-32(86(78,79)80)36(38(62)34(20)28)60-58-26-6-2-4-8-30(26)84(72,73)74;;;;;;/h1-18,61-62H,(H,63,64,65)(H,66,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77)(H,78,79,80)(H2,47,49,51,53,55)(H2,48,50,52,54,56);;;;;;/q;6*+1/p-6
hexasodium 4,4'-[1,4-phenylenebis[imino(6-chloro-1,3,5-triazine-4,2-diyl)imino]]bis[5-hydroxy-6-[(2-sulphonatophenyl)azo]naphthalene-2,7-disulphonate]

Molecular and structural information

Molecular formula:
C44H24Cl2N14Na6O20S6
Molecular weight:
1 470
SMILES notation:
[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[O-]S(=O)(=O)c9ccccc9N=Nc1c(O)c8c(cc1S([O-])(=O)=O)cc(cc8Nc2nc(nc(Cl)n2)Nc3ccc(cc3)Nc7nc(Nc5cc(cc6cc(c(N=Nc4ccccc4S([O-])(=O)=O)c(O)c56)S([O-])(=O)=O)S([O-])(=O)=O)nc(Cl)n7)S([O-])(=O)=O
InChl:
InChI=1/C44H30Cl2N14O20S6.6Na/c45-39-51-41(55-43(53-39)49-27-17-23(81(63,64)65)13-19-15-31(85(75,76)77)35(37(61)33(19)27)59-57-25-5-1-3-7-29(25)83(69,70)71)47-21-9-11-22(12-10-21)48-42-52-40(46)54-44(56-42)50-28-18-24(82(66,67)68)14-20-16-32(86(78,79)80)36(38(62)34(20)28)60-58-26-6-2-4-8-30(26)84(72,73)74;;;;;;/h1-18,61-62H,(H,63,64,65)(H,66,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77)(H,78,79,80)(H2,47,49,51,53,55)(H2,48,50,52,54,56);;;;;;/q;6*+1/p-6
Structural formula:
Chemical structure

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