Chemical Properties of Phenol, 4,4'-thiobis[2-(1,1-dimethylethyl)-6-methyl-

Phenol, 4,4'-thiobis[2-(1,1-dimethylethyl)-6-methyl-

InChI
InChI=1S/C22H30O2S/c1-13-9-15(11-17(19(13)23)21(3,4)5)25-16-10-14(2)20(24)18(12-16)22(6,7)8/h9-12,23-24H,1-8H3
InChI Key
YFHKLSPMRRWLKI-UHFFFAOYSA-N
Formula
C22H30O2S
SMILES
Cc1cc(Sc2cc(C)c(O)c(C(C)(C)C)c2)cc(C(C)(C)C)c1O
Molecular Weight1
358.55
Other Names
  • 3-tert-Butyl-4-hydroxy-5-methylphenyl sulfide
  • 4,4'-Thiobis(2-tert-butyl-6-methylphenol)
  • 4,4'-Thiobis(6-tert-butyl-o-cresol)
  • 6,6'-di-tert-butyl-4,4'-thiodi-o-cresol
  • Antioxidant 736
  • Antioxidant E 736
  • E 736
  • Ethanox 736
  • Ethyl 736
  • Ethyl Antioxidant 736
  • NSC 58409
  • TB 2
  • Thioalkofen BM
  • Tioalkofen BM
  • o-Cresol, 4,4'-thiobis(6-t-butyl-
  • o-Cresol, 4,4'-thiobis[6-tert-butyl-
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Physical Properties

Property Value Unit Source
ΔfH°gas -370.64 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 40.13 kJ/mol Joback Calculated Property
ΔvapH° 134.89 kJ/mol Relay (1.0) Calculated Property
IE 7.49 eV Relay (1.0) Calculated Property
logPoct/wat 6.461 Crippen Calculated Property
McVol 301.410 ml/mol McGowan Calculated Property
Tboil 645.67 K Relay (1.0) Calculated Property
Tfus 413.84 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [979.39; 1101.16] J/mol×K [999.80; 1258.33] Show Hide
Cp,gas 979.39 J/mol×K 999.80 Joback Calculated Property
Cp,gas 998.33 J/mol×K 1042.89 Joback Calculated Property
Cp,gas 1017.44 J/mol×K 1085.98 Joback Calculated Property
Cp,gas 1037.00 J/mol×K 1129.06 Joback Calculated Property
Cp,gas 1057.29 J/mol×K 1172.15 Joback Calculated Property
Cp,gas 1078.58 J/mol×K 1215.24 Joback Calculated Property
Cp,gas 1101.16 J/mol×K 1258.33 Joback Calculated Property

Similar Compounds

Santonox. Phenol, 2-(1,1-dimethylethyl)-6-methyl-. Phenol, 4,6-di(1,1-dimethylethyl)-2-methyl-. 6-t-Butyl-2,4-dimethylphenol. probucol. Phenol, 2,6-bis[[3-(1,1-dimethylethyl)-2-hydroxy-5-methylphenyl]methyl]-4-methyl-. Febutol. 3,3'-Di-tert-butyl-5,5'-dimethyl-2,2-dihydroxydiphenylmethane. 4,4'-Methylenebis(6-tert-butyl-o-cresol). 2-TERT-BUTYL-4-METHYL-6-(A-METHYLBENZYL)PHENOL. Phenol, 2,2'-methylenebis[6-(1,1-dimethylethyl)-4-ethyl-. 2,2'-Ethylidenebis(4,6-di-tert-butylphenol). 2-Allyl-6-t-butylphenol. P-cresol, 2,2'-methylene bis(6-(1,1,3,3-tetramethylbutyl))-. 2-(1,1-Dimethylethyl)-6-(1-methylethyl)phenol.

Find more compounds similar to Phenol, 4,4'-thiobis[2-(1,1-dimethylethyl)-6-methyl-.

Sources

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