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This is an old revision of this page, as edited by Beetstra (talk | contribs) at 14:10, 10 January 2012 (Saving copy of the {{chembox}} taken from revid 458204211 of page Trimesic_acid 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 14:10, 10 January 2012 by Beetstra (talk | contribs) (Saving copy of the {{chembox}} taken from revid 458204211 of page Trimesic_acid 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 458204211 of page Trimesic_acid with values updated to verified values.
WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Skeletal formula
Skeletal formula
Ball-and-stick model
Ball-and-stick model
Names
IUPAC name benzene-1,3,5-tricarboxylic acid
Identifiers
CAS Number
3D model (JSmol)
ChEBI
ChEMBL
ChemSpider
DrugBank
EC Number
  • 209-077-7
PubChem CID
InChI
  • InChI=1S/C9H6O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H,(H,10,11)(H,12,13)(H,14,15)Key: QMKYBPDZANOJGF-UHFFFAOYSA-N
  • InChI=1/C9H6O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H,(H,10,11)(H,12,13)(H,14,15)Key: QMKYBPDZANOJGF-UHFFFAOYAC
SMILES
  • c1c(cc(cc1C(=O)O)C(=O)O)C(=O)O
Properties
Chemical formula C9H6O6
Molar mass 210.14034
Acidity (pKa) 3.12, 3.89, 4.70
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). ☒N verify (what is  ?) Infobox references
Tracking categories (test):
Chemical compound
  1. Brown, H.C., et al., in Baude, E.A. and Nachod, F.C., Determination of Organic Structures by Physical Methods, Academic Press, New York, 1955.
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