Chem
J-GLOBAL ID：200907048529954118   Nikkaji number：J485.642B

2,2′-[(E)-Ethene-1,2-diyl]bis(5-isothiocyanatobenzenesulfonic acid)

2,2′-[(E)-エテン-1,2-ジイル]ビス(5-イソチオシアナトベンゼンスルホン酸)
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： C16H10N2O6S4
Molecular formula furigana： C16-H10-N2-O6-S4
Molecular weight： 454.500
InChI： InChI=1S/C16H10N2O6S4/c19-27(20,21)15-7-13(17-9-25)5-3-11(15)1-2-12-4-6-14(18-10-26)8-16(12)28(22,23)24/h1-8H,(H,19,20,21)(H,22,23,24)/b2-1+
InChI key： YSCNMFDFYJUPEF-OWOJBTEDSA-N
SMILES： OS(=O)(=O)c1cc(ccc1/C=C/c1ccc(cc1S(=O)(=O)O)N=C=S)N=C=S
Systematic name  (3)：
  • 2,2′-[(E)-エテン-1,2-ジイル]ビス(5-イソチオシアナトベンゼンスルホン酸)
  • 5-イソチオシアナト-2-[(1E)-2-(4-イソチオシアナト-2-スルホフェニル)エテニル]ベンゼン-1-スルホン酸
  • 5-isothiocyanato-2-[(1E)-2-(4-isothiocyanato-2-sulfophenyl)ethenyl]benzene-1-sulfonic acid
Other name (1)：
  • 2,2′-[(E)-Ethene-1,2-diyl]bis(5-isothiocyanatobenzenesulfonic acid)
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