Chem
J-GLOBAL ID:200907017577301298   Nikkaji number:J220.939J

Bis[1-[(4-methyl-3-nitrophenyl)azo]-2-hydroxy-6-naphthalenesulfonic acid]calcium salt

ビス[1-[(4-メチル-3-ニトロフェニル)アゾ]-2-ヒドロキシ-6-ナフタレンスルホン酸]カルシウム
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: C34H24CaN4[N+]2O10[O-]2S2
Molecular formula furigana: C34-H24-CA-N6-O12-S2
Molecular weight: 812.790
InChI: InChI=1S/2C17H13N3O6S.Ca/c2*1-10-2-4-12(9-15(10)20(22)23)18-19-17-14-6-5-13(27(24,25)26)8-11(14)3-7-16(17)21;/h2*2-9,21H,1H3,(H,24,25,26);/q;;+2/p-2
InChI key: XPDPAQIUVINWMZ-UHFFFAOYSA-L
SMILES: Cc1ccc(cc1[N+](=O)[O-])N=Nc1c(O)ccc2cc(ccc12)S(=O)(=O)O[Ca]OS(=O)(=O)c1ccc2c(N=Nc3ccc(C)c(c3)[N+](=O)[O-])c(O)ccc2c1
Systematic name  (3):
  • ビス[1-[(4-メチル-3-ニトロフェニル)アゾ]-2-ヒドロキシ-6-ナフタレンスルホン酸]カルシウム
  • [({6-ヒドロキシ-5-[2-(4-メチル-3-ニトロフェニル)ジアゼン-1-イル]ナフタレン-2-イル}スルホニル)オキシ]カルシオ 6-ヒドロキシ-5-[2-(4-メチル-3-ニトロフェニル)ジアゼン-1-イル]ナフタレン-2-スルホナート
  • [({6-hydroxy-5-[2-(4-methyl-3-nitrophenyl)diazen-1-yl]naphthalen-2-yl}sulfonyl)oxy]calcio 6-hydroxy-5-[2-(4-methyl-3-nitrophenyl)diazen-1-yl]naphthalene-2-sulfonate
Other name (1):
  • Bis[1-[(4-methyl-3-nitrophenyl)azo]-2-hydroxy-6-naphthalenesulfonic acid]calcium salt
Regulation number (1):
  • (4)-1116
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