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This is an old revision of this page, as edited by Beetstra (talk | contribs) at 13:43, 5 December 2011 (Saving copy of the {{chembox}} taken from revid 435389170 of page Ponceau_4R for the Chem/Drugbox validation project (updated: '').). The present address (URL) is a permanent link to this revision, which may differ significantly from the current revision.

Revision as of 13:43, 5 December 2011 by Beetstra (talk | contribs) (Saving copy of the {{chembox}} taken from revid 435389170 of page Ponceau_4R for the Chem/Drugbox validation project (updated: '').)(diff) ← Previous revision | Latest revision (diff) | Newer revision → (diff)
This page contains a copy of the infobox ({{chembox}}) taken from revid 435389170 of page Ponceau_4R with values updated to verified values.
Ponceau 4R
Ponceau 4R
Names
IUPAC name trisodium (8Z)-7-oxo-8-naphthalene-1,3-disulfonate
Identifiers
CAS Number
3D model (JSmol)
ChemSpider
PubChem CID
InChI
  • InChI=1S/C20H14N2O10S3.3Na/c23-16-7-5-11-9-12(33(24,25)26)10-18(35(30,31)32)19(11)20(16)22-21-15-6-8-17(34(27,28)29)14-4-2-1-3-13(14)15;;;/h1-10,23H,(H,24,25,26)(H,27,28,29)(H,30,31,32);;;/q;3*+1/p-3/b22-21+;;;Key: SWGJCIMEBVHMTA-ZRUFZDNISA-K
  • InChI=1/C20H14N2O10S3.3Na/c23-16-7-5-11-9-12(33(24,25)26)10-18(35(30,31)32)19(11)20(16)22-21-15-6-8-17(34(27,28)29)14-4-2-1-3-13(14)15;;;/h1-10,23H,(H,24,25,26)(H,27,28,29)(H,30,31,32);;;/q;3*+1/p-3/b22-21+;;;Key: SWGJCIMEBVHMTA-QWKJSYRZBY
SMILES
  • ...S(=O)(=O)c4ccc(/N=N/c1c2c(ccc1O)cc(cc2S()(=O)=O)S()(=O)=O)c3ccccc34
Properties
Chemical formula C20H11N2Na3O10S3
Molar mass 604.46 g·mol
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). checkverify (what is  ?) Infobox references
Tracking categories (test):
Chemical compound