Epoxypukalide

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Properties Simple | Detailed

Formula C21H24O7
IUPAC Name epoxypukalide
Molecular Mass 388.411 g·mol−1
Heat of Formation -843.5 ± 16.7 kJ·mol−1
Dipole Moment 4.03 ± 1.08 D
Volume 446.35 Å 3
Surface Area 353.47 Å 2
HOMO Energy -9.42 ± 0.55 eV
LUMO Energy -0.13 ± eV
Point Group Symmetry C1
Synonyms
  • 11,12-epoxypukalide
  • 11,16,18,19-tetraoxapentacyclo(12.2.2.1(6,9).0(1,15).0(10,12))nonadeca-6,8-diene-7-carboxylic acid, 12-methyl-4-(1-methylethenyl)-17-oxo-, methyl ester, (1r-(1r*,4s*,10r*,12s*,14r*,15r*))-
CAS Number(s)
  • 95925-22-7
InChIKey QKPWPHBMPBPNMQ-FELIULDUSA-N
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