Chemical Properties of Cyclopropanecarboxylic acid, 4-methoxyphenyl ester

InChI

InChI=1S/C11H12O3/c1-13-9-4-6-10(7-5-9)14-11(12)8-2-3-8/h4-8H,2-3H2,1H3

InChI Key

JUNVKRVSFQQOPN-UHFFFAOYSA-N

Formula

C11H12O3

SMILES

COc1ccc(OC(=O)C2CC2)cc1

Molecular Weight¹

192.21

• 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).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point 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 Temperature, Critical Pressure, Critical Volume, 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	[192.43; 471.61]	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			-2.60500e+01
Coefficient B			9.43320e-01
Coefficient C			-5.53360e-04
Coefficient D			1.07700e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	192.43	J/mol×K	273.00	Calculated Property
Cp,gas	243.19	J/mol×K	353.78	Calculated Property
Cp,gas	288.22	J/mol×K	434.56	Calculated Property
Cp,gas	327.86	J/mol×K	515.33	Calculated Property
Cp,gas	362.45	J/mol×K	596.11	Calculated Property
Cp,gas	392.34	J/mol×K	676.89	Calculated Property
Cp,gas	417.85	J/mol×K	757.67	Calculated Property
Cp,gas	439.35	J/mol×K	838.44	Calculated Property
Cp,gas	457.15	J/mol×K	919.22	Calculated Property
Cp,gas	471.61	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0016746; 0.0003518]	Pa×s	[335.17; 553.89]	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			-1.03434e+01
Coefficient B			1.32433e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			335.17
Temperature range, max.			553.89
η	0.0016746	Pa×s	335.17	Calculated Property
η	0.0012821	Pa×s	359.47	Calculated Property
η	0.0010153	Pa×s	383.77	Calculated Property
η	0.0008267	Pa×s	408.08	Calculated Property
η	0.0006888	Pa×s	432.38	Calculated Property
η	0.0005852	Pa×s	456.68	Calculated Property
η	0.0005055	Pa×s	480.98	Calculated Property
η	0.0004428	Pa×s	505.28	Calculated Property
η	0.0003926	Pa×s	529.58	Calculated Property
η	0.0003518	Pa×s	553.89	Calculated Property

Similar Compounds

Find more compounds similar to Cyclopropanecarboxylic acid, 4-methoxyphenyl 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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