(3E)-3-[4-Hydroxy-3,5-Bis(2-Methyl-2-Propanyl)Benzylidene]-1-Methoxy-2-Pyrrolidinone

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Properties Simple | Detailed

Formula C20H29NO3
IUPAC Name (3e)-3-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylene]-1-methoxy-pyrrolidin-2-one
Molecular Mass 331.449 g·mol−1
Heat of Formation -433.0 ± 16.7 kJ·mol−1
Dipole Moment 4.18 ± 1.08 D
Volume 432.7 Å 3
Surface Area 365.74 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy -0.17 ± eV
Point Group Symmetry C1
Synonyms
  • (3e)-3-(3,5-ditert-butyl-4-hydroxy-benzylidene)-1-methoxy-2-pyrrolidone
  • (3e)-3-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylene]-1-methoxy-pyrrolidin-2-one
  • (3e)-3-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylidene]-1-methoxy-pyrrolidin-2-one
  • (3e)-3-[(3,5-ditert-butyl-4-hydroxyphenyl)methylene]-1-methoxy-2-pyrrolidinone
  • (3e)-3-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-1-methoxypyrrolidin-2-one
  • 2-pyrrolidinone, 3-((3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene)-1-methoxy-
  • 3-((3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene)-1-methoxy-2-pyrrolidinone
  • e 5110
  • n-methoxy-3-(3,5-di-tert-butyl-4-hydroxybenzylidene)-2-pyrrolidone
CAS Number(s)
  • 107746-52-1
InChIKey NJTQENWDJVHUOX-GXDHUFHOSA-N
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