Chemical Properties of Ethyl-3-methoxybenzoate

InChI

InChI=1S/C10H12O3/c1-3-13-10(11)8-5-4-6-9(7-8)12-2/h4-7H,3H2,1-2H3

InChI Key

GSQLMBQLTPEPHD-UHFFFAOYSA-N

Formula

C10H12O3

SMILES

CCOC(=O)c1cccc(OC)c1

Molecular Weight¹

180.20

Other Names

• ethyl m-anisate
• Benzoic acid, 3-methoxy-, ethyl ester

• 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_boilr : Boiling point at reduced pressure (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.

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[194.66; 440.28]	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			2.51010e+01
Coefficient B			6.97440e-01
Coefficient C			-2.78760e-04
Coefficient D			-3.50000e-09
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	194.66	J/mol×K	273.00	Calculated Property
Cp,gas	236.80	J/mol×K	353.78	Calculated Property
Cp,gas	275.25	J/mol×K	434.56	Calculated Property
Cp,gas	310.01	J/mol×K	515.33	Calculated Property
Cp,gas	341.05	J/mol×K	596.11	Calculated Property
Cp,gas	368.38	J/mol×K	676.89	Calculated Property
Cp,gas	391.98	J/mol×K	757.67	Calculated Property
Cp,gas	411.84	J/mol×K	838.44	Calculated Property
Cp,gas	427.94	J/mol×K	919.22	Calculated Property
Cp,gas	440.28	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0018842; 0.0001745]	Pa×s	[305.96; 524.76]	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			-1.19809e+01
Coefficient B			1.74601e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			305.96
Temperature range, max.			524.76
η	0.0018842	Pa×s	305.96	Calculated Property
η	0.0012379	Pa×s	330.27	Calculated Property
η	0.0008615	Pa×s	354.58	Calculated Property
η	0.0006282	Pa×s	378.89	Calculated Property
η	0.0004758	Pa×s	403.20	Calculated Property
η	0.0003719	Pa×s	427.52	Calculated Property
η	0.0002985	Pa×s	451.83	Calculated Property
η	0.0002451	Pa×s	476.14	Calculated Property
η	0.0002051	Pa×s	500.45	Calculated Property
η	0.0001745	Pa×s	524.76	Calculated Property

Similar Compounds

Find more compounds similar to Ethyl-3-methoxybenzoate.

Sources

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

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