3-(3,5-Di-Tert-Butyl-4-Hydroxyphenyl)-2,2-Dimethylpropanal

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Properties Simple | Detailed

Formula C19H30O2
IUPAC Name 3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2,2-dimethyl-propanal
Molecular Mass 290.440 g·mol−1
Heat of Formation -506.3 ± 16.7 kJ·mol−1
Dipole Moment 3.28 ± 1.08 D
Volume 407.32 Å 3
Surface Area 326.64 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy 0.27 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(3',5'-di-tert-butyl-4'-hydroxy)phenyl-2,2-dimethylpropanal
  • 3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2,2-dimethyl-propionaldehyde
  • 3-(3,5-ditert-butyl-4-hydroxyphenyl)-2,2-dimethylpropanal
  • cgp-13501
  • tocris-1514
InChIKey XGWATTXMMMANFJ-UHFFFAOYSA-N
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