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This is an old revision of this page, as edited by Beetstra (talk | contribs) at 12:10, 5 December 2011 (Saving copy of the {{chembox}} taken from revid 438224066 of page Phenyl-C61-butyric_acid_methyl_ester 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 12:10, 5 December 2011 by Beetstra (talk | contribs) (Saving copy of the {{chembox}} taken from revid 438224066 of page Phenyl-C61-butyric_acid_methyl_ester 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 438224066 of page Phenyl-C61-butyric_acid_methyl_ester with values updated to verified values.
WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Structural formula of phenyl-C61-butyric acid methyl ester
Names
Preferred IUPAC name Phenyl-C61-butyric acid methyl ester
Identifiers
3D model (JSmol)
ChemSpider
InChI
  • InChI=1S/C72H14O2/c1-74-11(73)8-5-9-70(10-6-3-2-4-7-10)71-66-58-50-40-30-22-14-12-13-16-20-18(14)26-34-28(20)38-32-24(16)25-17(13)21-19-15(12)23(22)31-37-27(19)35-29(21)39-33(25)43-42(32)52-46(38)56-48(34)54(44(50)36(26)30)62(66)64(56)68-60(52)61-53(43)47(39)57-49(35)55-45(37)51(41(31)40)59(58)67(71)63(55)65(57)69(61)72(68,70)71/h2-4,6-7H,5,8-9H2,1H3Key: FIGVSQKKPIKBST-UHFFFAOYSA-N
  • Key: FIGVSQKKPIKBST-UHFFFAOYSA-N
SMILES
  • COC(=O)CCCC1(C23=C14c5c6c7c8c9c1c%10c%11c%12c%13c%14c%10c%10c9c7c7c5c5c2c2c9c%15c(c%13c%13c%12c%12c%16c%11c1c1c8c8c6c4c4c6c8c1c%16c1c%12c8c%13c%15c%11c8c(c16)c4c3c%112)c1c%14c%10c7c5c19)c1ccccc1
Properties
Chemical formula C72H14O2
Molar mass 910.902 g·mol
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). checkY verify (what is  ?) Infobox references
Tracking categories (test):
Chemical compound