Chemical Properties of 4-Methylbenzoic acid anhydride (CAS 13222-85-0)

InChI

InChI=1S/C16H14O3/c1-11-3-7-13(8-4-11)15(17)19-16(18)14-9-5-12(2)6-10-14/h3-10H,1-2H3

InChI Key

BJMLLSSSTGHJJE-UHFFFAOYSA-N

Formula

C16H14O3

SMILES

Cc1ccc(C(=O)OC(=O)c2ccc(C)cc2)cc1

Molecular Weight¹

254.28

CAS

13222-85-0

• ω : Acentric Factor.
• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_solid : Solid phase 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).
• 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	[531.45; 597.96]	J/mol×K	[758.96; 998.86]
Cp,gas	531.45	J/mol×K	758.96	Joback Calculated Property
Cp,gas	545.35	J/mol×K	798.94	Joback Calculated Property
Cp,gas	558.06	J/mol×K	838.93	Joback Calculated Property
Cp,gas	569.64	J/mol×K	878.91	Joback Calculated Property
Cp,gas	580.13	J/mol×K	918.89	Joback Calculated Property
Cp,gas	589.55	J/mol×K	958.87	Joback Calculated Property
Cp,gas	597.96	J/mol×K	998.86	Joback Calculated Property
η	[0.0001235; 0.0008599]	Pa×s	[470.05; 758.96]
η	0.0008599	Pa×s	470.05	Joback Calculated Property
η	0.0005355	Pa×s	518.20	Joback Calculated Property
η	0.0003615	Pa×s	566.35	Joback Calculated Property
η	0.0002595	Pa×s	614.50	Joback Calculated Property
η	0.0001955	Pa×s	662.66	Joback Calculated Property
η	0.0001530	Pa×s	710.81	Joback Calculated Property
η	0.0001235	Pa×s	758.96	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4-Methylbenzoic acid anhydride.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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