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This is an old revision of this page, as edited by Beetstra (talk | contribs) at 13:39, 6 December 2011 (Saving copy of the {{chembox}} taken from revid 421120630 of page Santonic_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 13:39, 6 December 2011 by Beetstra (talk | contribs) (Saving copy of the {{chembox}} taken from revid 421120630 of page Santonic_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 421120630 of page Santonic_acid with values updated to verified values.
WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Names
IUPAC name (−)-2,3,3a,4,5,6,7,7a-octahydro-α,3a,5-trimethyl-6,8-dioxo-1,4-methano-1H-indene-1-acetic acid
Identifiers
3D model (JSmol)
ChemSpider
PubChem CID
InChI
  • InChI=1S/C15H20O4/c1-7-9(16)6-10-14(3)4-5-15(10,8(2)13(18)19)12(17)11(7)14/h7-8,10-11H,4-6H2,1-3H3,(H,18,19)Key: UNPYYTKZOHYHMZ-UHFFFAOYSA-N
  • InChI=1/C15H20O4/c1-7-9(16)6-10-14(3)4-5-15(10,8(2)13(18)19)12(17)11(7)14/h7-8,10-11H,4-6H2,1-3H3,(H,18,19)Key: UNPYYTKZOHYHMZ-UHFFFAOYAW
SMILES
  • O=C(O)C(C31C(=O)C2C(C(=O)CC1C2(CC3)C)C)C
Properties
Chemical formula C15H20O4
Molar mass 264.32 g mol
Density 1.184 g cm
Melting point 173 °C
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
  1. ^ A. P. J. Brunskill, H. W. Thompson and R. A. Lalancette (1999). "Santonic acid: catemeric hydrogen bonding in a γ,ε-diketo carboxylic acid". Acta Cryst. C55 (4): 566–568. doi:10.1107/S0108270198014231. {{cite journal}}: Unknown parameter |month= ignored (help)
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