Chemical Properties of p-Methoxybenzoic acid, 2-methylphenyl ester

InChI

InChI=1S/C15H14O3/c1-11-5-3-4-6-14(11)18-15(16)12-7-9-13(17-2)10-8-12/h3-10H,1-2H3

InChI Key

ZKDVXYLPRGTJQM-UHFFFAOYSA-N

Formula

C15H14O3

SMILES

COc1ccc(C(=O)Oc2ccccc2C)cc1

Molecular Weight¹

242.27

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[246.02; 576.67]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			9.50000e-01
Coefficient B			1.03404e+00
Coefficient C			-5.14920e-04
Coefficient D			5.66000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	246.02	J/mol×K	273.00	Calculated Property
Cp,gas	304.83	J/mol×K	353.78	Calculated Property
Cp,gas	357.71	J/mol×K	434.56	Calculated Property
Cp,gas	404.82	J/mol×K	515.33	Calculated Property
Cp,gas	446.37	J/mol×K	596.11	Calculated Property
Cp,gas	482.51	J/mol×K	676.89	Calculated Property
Cp,gas	513.43	J/mol×K	757.67	Calculated Property
Cp,gas	539.31	J/mol×K	838.44	Calculated Property
Cp,gas	560.33	J/mol×K	919.22	Calculated Property
Cp,gas	576.67	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0009214; 0.0001164]	Pa×s	[401.25; 644.65]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.24699e+01
Coefficient B			2.19897e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			401.25
Temperature range, max.			644.65
η	0.0009214	Pa×s	401.25	Calculated Property
η	0.0006519	Pa×s	428.29	Calculated Property
η	0.0004805	Pa×s	455.34	Calculated Property
η	0.0003666	Pa×s	482.38	Calculated Property
η	0.0002878	Pa×s	509.43	Calculated Property
η	0.0002315	Pa×s	536.47	Calculated Property
η	0.0001902	Pa×s	563.51	Calculated Property
η	0.0001590	Pa×s	590.56	Calculated Property
η	0.0001351	Pa×s	617.60	Calculated Property
η	0.0001164	Pa×s	644.65	Calculated Property

Similar Compounds

Find more compounds similar to p-Methoxybenzoic acid, 2-methylphenyl ester.

Sources

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

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