Chemical Properties of 4-(4-Acetoxy-5-tert-butyl-2-methylphenyl)sulfanyl-2-tert-butyl-6-methylphenyl] acetate (CAS 32604-54-9)

InChI

InChI=1S/C26H34O4S/c1-15-11-21(29-17(3)27)19(25(5,6)7)13-23(15)31-24-14-20(26(8,9)10)22(12-16(24)2)30-18(4)28/h11-14H,1-10H3

InChI Key

HJVRTJOXJRZISJ-UHFFFAOYSA-N

Formula

C26H34O4S

SMILES

CC(=O)Oc1cc(C)c(Sc2cc(C(C)(C)C)c(OC(C)=O)cc2C)cc1C(C)(C)C

Molecular Weight¹

442.61

CAS

32604-54-9

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1182.39; 1231.85]	J/mol×K	[1092.42; 1343.23]
Cp,gas	1182.39	J/mol×K	1092.42	Joback Calculated Property
Cp,gas	1194.32	J/mol×K	1134.22	Joback Calculated Property
Cp,gas	1204.67	J/mol×K	1176.02	Joback Calculated Property
Cp,gas	1213.51	J/mol×K	1217.83	Joback Calculated Property
Cp,gas	1220.94	J/mol×K	1259.63	Joback Calculated Property
Cp,gas	1227.02	J/mol×K	1301.43	Joback Calculated Property
Cp,gas	1231.85	J/mol×K	1343.23	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4-(4-Acetoxy-5-tert-butyl-2-methylphenyl)sulfanyl-2-tert-butyl-6-methylphenyl] acetate.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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