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

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Properties Simple | Detailed

Formula C19H27NO2S
IUPAC Name (5e)-5-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylene]-3-methyl-thiazolidin-4-one
Molecular Mass 333.488 g·mol−1
Heat of Formation -360.5 ± 16.7 kJ·mol−1
Dipole Moment 2.18 ± 1.08 D
Volume 420.9 Å 3
Surface Area 354.68 Å 2
HOMO Energy -8.30 ± 0.55 eV
LUMO Energy -0.51 ± eV
Point Group Symmetry C1
Synonyms
  • (5e)-5-(3,5-ditert-butyl-4-hydroxy-benzylidene)-3-methyl-thiazolidin-4-one
  • (5e)-5-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylene]-3-methyl-thiazolidin-4-one
  • (5e)-5-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylidene]-3-methyl-1,3-thiazolidin-4-one
  • (5e)-5-[(3,5-ditert-butyl-4-hydroxyphenyl)methylene]-3-methyl-4-thiazolidinone
  • (5e)-5-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-3-methyl-1,3-thiazolidin-4-one
InChIKey IXCMEASJCGKKQS-XNTDXEJSSA-N
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