Chemical Properties of 2(5H)-Thiophenone, 5-methyl- (CAS 7210-64-2)

InChI

InChI=1S/C5H6OS/c1-4-2-3-5(6)7-4/h2-4H,1H3

InChI Key

QDQVRZPVOVZFMA-UHFFFAOYSA-N

Formula

C5H6OS

SMILES

CC1C=CC(=O)S1

Molecular Weight¹

114.17

CAS

7210-64-2

Other Names

• 5-Methyl-2(5H)-thiophenone

• 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).
• IE : Ionization energy (eV).
• 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	[153.55; 209.62]	J/mol×K	[443.89; 683.84]
Cp,gas	153.55	J/mol×K	443.89	Joback Calculated Property
Cp,gas	164.15	J/mol×K	483.88	Joback Calculated Property
Cp,gas	174.26	J/mol×K	523.87	Joback Calculated Property
Cp,gas	183.86	J/mol×K	563.86	Joback Calculated Property
Cp,gas	192.96	J/mol×K	603.86	Joback Calculated Property
Cp,gas	201.55	J/mol×K	643.85	Joback Calculated Property
Cp,gas	209.62	J/mol×K	683.84	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2(5H)-Thiophenone, 5-methyl-.

Sources

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

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