1391054-68-4

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1391054-68-4 Structure

Identification	Back Directory
[Name] 4-[(3,5-Di-tert-butyl-2-hydroxyphenylthio)isopropylidenethio]-2,6-di-tert-butylphenol
[CAS] 1391054-68-4
[Synonyms] Probucol USP RC C 4'-Deoxy-2'-hydroxy Probucol Probucol USP Related Compound C 4'-Deoxy-2'-hydroxy Probucol DISCONTINUED 4-[(3,5-Di-tert-butyl-2-hydroxyphenylthio)isopropylidenethio]-2,6-di-tert-butylphenol Probucol Related Compound C (4-[(3,5-di-tert-butyl-2-hydroxyphenylthio)isopropylidenethio]-2,6-di-t (1563342) Phenol, 2-[[1-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]thio]-1-methylethyl]thio]-4,6-bis(1,1-dimethylethyl)- 4-[(3,5-Di-tert-butyl-2-hydroxyphenylthio)isopropylidenethio]-2,6-di-tert-butylphenol (4,4'-(propane-2,2-diylbis(sulfanediyl))bis(2,6-di-tert-butylphenol)/4'-?Deoxy-?2'-?hydroxy Probucol)
[Molecular Formula] C31H48O2S2
[MDL Number] MFCD28369369
[MOL File] 1391054-68-4.mol
[Molecular Weight] 516.84

Chemical Properties	Back Directory
[Boiling point ] 539.7±50.0 °C(Predicted)
[density ] 1.07±0.1 g/cm3(Predicted)
[pka] 10.56±0.50(Predicted)
[InChI] InChI=1S/C31H48O2S2/c1-27(2,3)19-15-21(28(4,5)6)26(33)24(16-19)35-31(13,14)34-20-17-22(29(7,8)9)25(32)23(18-20)30(10,11)12/h15-18,32-33H,1-14H3
[InChIKey] JFBAVBRCJKPJRP-UHFFFAOYSA-N
[SMILES] C1(O)=C(C(C)(C)C)C=C(C(C)(C)C)C=C1SC(SC1=CC(C(C)(C)C)=C(O)C(C(C)(C)C)=C1)(C)C

Safety Data	Back Directory
[HS Code ] 2930902000

Hazard Information	Back Directory
[Uses] 4’-Deoxy-2’-hydroxy Probucol is an impurity of the antilipemic, Probucol (P755100).

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