(3E)-3-[4-Hydroxy-3,5-Bis(2-Methyl-2-Propanyl)Benzylidene]Dihydro-2(3H)-Furanone

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Properties Simple | Detailed

Formula C19H26O3
IUPAC Name (3e)-3-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylene]tetrahydrofuran-2-one
Molecular Mass 302.408 g·mol−1
Heat of Formation -566.3 ± 16.7 kJ·mol−1
Dipole Moment 6.13 ± 1.08 D
Volume 394.1 Å 3
Surface Area 332.13 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy -0.21 ± eV
Point Group Symmetry C1
Synonyms
  • (3e)-3-(3,5-ditert-butyl-4-hydroxy-benzylidene)tetrahydrofuran-2-one
  • (3e)-3-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylene]tetrahydrofuran-2-one
  • (3e)-3-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylidene]oxolan-2-one
  • (3e)-3-[(3,5-ditert-butyl-4-hydroxyphenyl)methylene]-2-tetrahydrofuranone
  • (3e)-3-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]oxolan-2-one
  • 2(3h)-furanone, 3-((3,5-bis(1,1-dimethyethyl)-4-hydroxyphenyl)methylene)dihydro-
  • alpha-(3,5-di-tert-butyl-4-hydroxybenzylidene)gamma-butyrolactone
  • kme 4
  • kme-4
CAS Number(s)
  • 83677-24-1
InChIKey DFPYHQJPGCODSB-UKTHLTGXSA-N
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