CHEBI:36511 - 4,4'-diisothiocyanostilbene-2,2'-disulfonic acid

Main ChEBI Ontology Automatic Xrefs
ChEBI Name 4,4'-diisothiocyanostilbene-2,2'-disulfonic acid
ChEBI ID CHEBI:36511
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C16H10N2O6S4
Net Charge 0
Average Mass 454.52448
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)
InChIKey YSCNMFDFYJUPEF-UHFFFAOYSA-N
SMILES [H]C(=C([H])c1ccc(cc1S(O)(=O)=O)N=C=S)c1ccc(cc1S(O)(=O)=O)N=C=S
ChEBI Ontology
Outgoing 4,4'-diisothiocyanostilbene-2,2'-disulfonic acid (CHEBI:36511) is a arenesulfonic acid (CHEBI:33555)
Incoming 4,4'-diisothiocyano-cis-stilbene-2,2'-disulfonic acid (CHEBI:36512) is a 4,4'-diisothiocyanostilbene-2,2'-disulfonic acid (CHEBI:36511)
4,4'-diisothiocyano-trans-stilbene-2,2'-disulfonic acid (CHEBI:4286) is a 4,4'-diisothiocyanostilbene-2,2'-disulfonic acid (CHEBI:36511)
IUPAC Name
5,5'-diisothiocyanato-2,2'-(ethene-1,2-diyl)dibenzenesulfonic acid
Synonym Source
2,2'-ethene-1,2-diylbis(5-isothiocyanatobenzenesulfonic acid) IUPAC
Registry Number Type Source
6543839 Beilstein Registry Number Beilstein
Last Modified
13 April 2007