Chem
J-GLOBAL ID：200907021627103775   Nikkaji number：J318.324F

2,2′-[(3,3′-Dimethoxy-4,4′-biphenylylene)bis[azo(methylimino)]]bis(ethanesulfonic acid sodium) salt

2,2′-[(3,3′-ジメトキシ-4,4′-ビフェニリレン)ビス[アゾ(メチルイミノ)]]ビス(エタンスルホン酸ナトリウム)
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C20H26N6Na2O8S2
Molecular formula furigana： C20-H26-N6-NA2-O8-S2
Molecular weight： 588.560
InChI： InChI=1S/C20H28N6O8S2.2Na/c1-25(9-11-35(27,28)29)23-21-17-7-5-15(13-19(17)33-3)16-6-8-18(20(14-16)34-4)22-24-26(2)10-12-36(30,31)32;;/h5-8,13-14H,9-12H2,1-4H3,(H,27,28,29)(H,30,31,32);;/q;2*+1/p-2
InChI key： LLTLPCRATLSODZ-UHFFFAOYSA-L
SMILES： COc1cc(ccc1N=NN(C)CCS(=O)(=O)O[Na])c1ccc(N=NN(C)CCS(=O)(=O)O[Na])c(OC)c1
Systematic name  (3)：
  • 2,2′-[(3,3′-ジメトキシ-4,4′-ビフェニリレン)ビス[アゾ(メチルイミノ)]]ビス(エタンスルホン酸ナトリウム)
  • ナトリウム 2-{3-[3,3'-ジメトキシ-4'-(3-メチル-3-{2-[(ソジオオキシ)スルホニル]エチル}トリアザ-1-エン-1-イル)-[1,1'-ビフェニル]-4-イル]-1-メチルトリアザ-2-エン-1-イル}エタン-1-スルホナート
  • sodium 2-{3-[3,3'-dimethoxy-4'-(3-methyl-3-{2-[(sodiooxy)sulfonyl]ethyl}triaz-1-en-1-yl)-[1,1'-biphenyl]-4-yl]-1-methyltriaz-2-en-1-yl}ethane-1-sulfonate
Other name (1)：
  • 2,2′-[(3,3′-Dimethoxy-4,4′-biphenylylene)bis[azo(methylimino)]]bis(ethanesulfonic acid sodium) salt
CAS registry number： 17011-51-7
Regulation number (2)：
  • EINECS2410856
  • TSCA(17011-51-7)
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