Chemical Properties of Phenol, 3,5-dimethyl-4-(methylthio)- (CAS 7379-51-3)

InChI

InChI=1S/C9H12OS/c1-6-4-8(10)5-7(2)9(6)11-3/h4-5,10H,1-3H3

InChI Key

JGFZITGNFAVSKU-UHFFFAOYSA-N

Formula

C9H12OS

SMILES

CSc1c(C)cc(O)cc1C

Molecular Weight¹

168.26

CAS

7379-51-3

Other Names

• 4-(methylthio)-3,5-xylenol

• 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	[313.17; 375.94]	J/mol×K	[591.36; 835.91]
Cp,gas	313.17	J/mol×K	591.36	Joback Calculated Property
Cp,gas	325.41	J/mol×K	632.12	Joback Calculated Property
Cp,gas	336.84	J/mol×K	672.88	Joback Calculated Property
Cp,gas	347.54	J/mol×K	713.64	Joback Calculated Property
Cp,gas	357.58	J/mol×K	754.39	Joback Calculated Property
Cp,gas	367.02	J/mol×K	795.15	Joback Calculated Property
Cp,gas	375.94	J/mol×K	835.91	Joback Calculated Property

Similar Compounds

Find more compounds similar to Phenol, 3,5-dimethyl-4-(methylthio)-.

Sources

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

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