4-{[4-Hydroxy-3,5-Bis(2-Methyl-2-Propanyl)Benzoyl]Amino}Benzoic Acid

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Properties Simple | Detailed

Formula C22H27NO4
IUPAC Name 4-[(3,5-ditert-butyl-4-hydroxy-benzoyl)amino]benzoic acid
Molecular Mass 369.454 g·mol−1
Heat of Formation -731.3 ± 16.7 kJ·mol−1
Dipole Moment 7.30 ± 1.08 D
Volume 456.19 Å 3
Surface Area 395.49 Å 2
HOMO Energy -9.12 ± 0.55 eV
LUMO Energy -0.68 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[(3,5-ditert-butyl-4-hydroxy-phenyl)carbonylamino]benzoic acid
  • 4-[(3,5-ditert-butyl-4-hydroxybenzoyl)amino]benzoic acid
  • 4-[[(3,5-ditert-butyl-4-hydroxyphenyl)-oxomethyl]amino]benzoic acid
  • r 8605
  • r-8605
CAS Number(s)
  • 139466-09-4
  • 119306-51-3
InChIKey SOUMNAXAAYKDPQ-UHFFFAOYSA-N
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