Chem
J-GLOBAL ID:200907010222982842   Nikkaji number:J55.765J

C.I.31865

ベンゾブラックブルーG
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: C42H24N6Na4O14S4
Molecular formula furigana: C42-H24-N6-NA4-O14-S4
Molecular weight: 1056.880
InChI: InChI=1S/C42H28N6O14S4.4Na/c49-41-29-11-5-3-9-27(29)37(63(51,52)53)21-35(41)47-44-32-18-17-31(25-7-1-2-8-26(25)32)43-45-33-15-13-23(19-39(33)65(57,58)59)24-14-16-34(40(20-24)66(60,61)62)46-48-36-22-38(64(54,55)56)28-10-4-6-12-30(28)42(36)50;;;;/h1-22,49-50H,(H,51,52,53)(H,54,55,56)(H,57,58,59)(H,60,61,62);;;;/q;4*+1/p-4
InChI key: HGKVUICGXSCANW-UHFFFAOYSA-J
SMILES: Oc1c(cc(c2ccccc12)S(=O)(=O)O[Na])N=Nc1ccc(cc1S(=O)(=O)O[Na])c1ccc(N=Nc2ccc(N=Nc3cc(c4ccccc4c3O)S(=O)(=O)O[Na])c3ccccc23)c(c1)S(=O)(=O)O[Na]
Systematic name  (3):
  • 4-[(1-ヒドロキシ-4-ソジオスルホ-2-ナフタレニル)アゾ]-4′-[[4-[(1-ヒドロキシ-4-ソジオスルホ-2-ナフタレニル)アゾ]-1-ナフタレニル]アゾ]-1,1′-ビフェニル-3,3′-ジスルホン酸二ナトリウム
  • 3,3'-二ナトリウム 4-(2-{1-ヒドロキシ-4-[(ソジオオキシ)スルホニル]ナフタレン-2-イル}ジアゼン-1-イル)-4'-{2-[4-(2-{1-ヒドロキシ-4-[(ソジオオキシ)スルホニル]ナフタレン-2-イル}ジアゼン-1-イル)ナフタレン-1-イル]ジアゼン-1-イル}-[1,1'-ビフェニル]-3,3'-ジスルホナート
  • 3,3'-disodium 4-(2-{1-hydroxy-4-[(sodiooxy)sulfonyl]naphthalen-2-yl}diazen-1-yl)-4'-{2-[4-(2-{1-hydroxy-4-[(sodiooxy)sulfonyl]naphthalen-2-yl}diazen-1-yl)naphthalen-1-yl]diazen-1-yl}-[1,1'-biphenyl]-3,3'-disulfonate
Other name (4):
  • ベンゾブラックブルーG
  • C.I.31865
  • Benzo Black Blue G
  • 4-[(1-Hydroxy-4-sodiosulfo-2-naphthalenyl)azo]-4′-[[4-[(1-hydroxy-4-sodiosulfo-2-naphthalenyl)azo]-1-naphthalenyl]azo]-1,1′-biphenyl-3,3′-disulfonic acid disodium salt
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