Probucol

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Properties Simple | Detailed

Formula C31H48O2S2
IUPAC Name 2,6-ditert-butyl-4-[1-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanyl-1-methyl-ethyl]sulfanyl-phenol
Molecular Mass 516.842 g·mol−1
Heat of Formation -613.6 ± 16.7 kJ·mol−1
Dipole Moment 3.76 ± 1.08 D
Volume 689.34 Å 3
Surface Area 525.53 Å 2
HOMO Energy -8.29 ± 0.55 eV
LUMO Energy 2.92 ± eV
Point Group Symmetry C1
Synonyms
  • 2,6-ditert-butyl-4-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanylpropan-2-ylsulfanyl]phenol
  • 2,6-ditert-butyl-4-[2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylpropan-2-ylsulfanyl]phenol
  • 2,6-ditert-butyl-4-[[1-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]-1-methyl-ethyl]thio]phenol
  • 2,6-ditert-butyl-4-[[1-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]-1-methylethyl]thio]phenol
  • 4,4'-(isopropylidenedithio)bis(2,6-di-tert-butylphenol)
  • 4,4'-(isopropylidenedithio)bis[2,6-di-tert-butylphenol]
  • acetone bis(3,5-di-tert-butyl-4-hydroxyphenyl) mercaptole
  • acetone, bis(3,5-di-tert-butyl-4-hydroxyphenyl) mercaptole
  • biphenabid
  • bisbid
  • bisphenabid
  • bpbio1_000625
  • cmap_000039
  • d00476
  • de-3872
  • dh 581
  • dh-581
  • lesterol
  • lorelco
  • lursell
  • lurselle
  • panavir
  • phenol, 4,4'-((1-methylethylidene)bis(thio))bis(2,6-bis(1,1-dimethylethyl)-
  • phenol, 4,4'-[(1-methylethylidene)bis(thio)]bis[2,6-bis(1,1-dimethylethyl)-
  • probucol (jan/usp/inn)
  • sinlestal
  • zero/001429
CAS Number(s)
  • 23288-49-5
InChIKey FYPMFJGVHOHGLL-UHFFFAOYSA-N
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