Chemical Properties of Carbonic acid, 2-methoxyethyl 3-methylphenyl ester

InChI

InChI=1S/C11H14O4/c1-9-4-3-5-10(8-9)15-11(12)14-7-6-13-2/h3-5,8H,6-7H2,1-2H3

InChI Key

LXJDSIJCXUOMIW-UHFFFAOYSA-N

Formula

C11H14O4

SMILES

COCCOC(=O)Oc1cccc(C)c1

Molecular Weight¹

210.23

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion 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).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[231.27; 510.37]	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			4.96920e+01
Coefficient B			7.29240e-01
Coefficient C			-2.22160e-04
Coefficient D			-4.64000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	231.27	J/mol×K	273.00	Calculated Property
Cp,gas	277.82	J/mol×K	353.78	Calculated Property
Cp,gas	320.83	J/mol×K	434.56	Calculated Property
Cp,gas	360.14	J/mol×K	515.33	Calculated Property
Cp,gas	395.63	J/mol×K	596.11	Calculated Property
Cp,gas	427.13	J/mol×K	676.89	Calculated Property
Cp,gas	454.50	J/mol×K	757.67	Calculated Property
Cp,gas	477.59	J/mol×K	838.44	Calculated Property
Cp,gas	496.27	J/mol×K	919.22	Calculated Property
Cp,gas	510.37	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0013185; 0.0001417]	Pa×s	[339.46; 552.79]	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			-1.24118e+01
Coefficient B			1.96226e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			339.46
Temperature range, max.			552.79
η	0.0013185	Pa×s	339.46	Calculated Property
η	0.0009041	Pa×s	363.16	Calculated Property
η	0.0006493	Pa×s	386.87	Calculated Property
η	0.0004845	Pa×s	410.57	Calculated Property
η	0.0003732	Pa×s	434.27	Calculated Property
η	0.0002954	Pa×s	457.97	Calculated Property
η	0.0002393	Pa×s	481.68	Calculated Property
η	0.0001976	Pa×s	505.38	Calculated Property
η	0.0001661	Pa×s	529.08	Calculated Property
η	0.0001417	Pa×s	552.79	Calculated Property

Similar Compounds

Find more compounds similar to Carbonic acid, 2-methoxyethyl 3-methylphenyl ester.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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