Chemical Properties of Carbonic acid, ethyl 4-chlorophenyl ester

InChI

InChI=1S/C9H9ClO3/c1-2-12-9(11)13-8-5-3-7(10)4-6-8/h3-6H,2H2,1H3

InChI Key

YVZRSAKDPDOUPK-UHFFFAOYSA-N

Formula

C9H9ClO3

SMILES

CCOC(=O)Oc1ccc(Cl)cc1

Molecular Weight¹

200.62

• 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_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, 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	[186.85; 396.96]	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			3.89010e+01
Coefficient B			6.09220e-01
Coefficient C			-2.44760e-04
Coefficient D			-6.40000e-09
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	186.85	J/mol×K	273.00	Calculated Property
Cp,gas	223.51	J/mol×K	353.78	Calculated Property
Cp,gas	256.90	J/mol×K	434.56	Calculated Property
Cp,gas	286.98	J/mol×K	515.33	Calculated Property
Cp,gas	313.73	J/mol×K	596.11	Calculated Property
Cp,gas	337.15	J/mol×K	676.89	Calculated Property
Cp,gas	357.20	J/mol×K	757.67	Calculated Property
Cp,gas	373.86	J/mol×K	838.44	Calculated Property
Cp,gas	387.12	J/mol×K	919.22	Calculated Property
Cp,gas	396.96	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0017431; 0.0001849]	Pa×s	[324.61; 540.56]	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			-1.19686e+01
Coefficient B			1.82317e+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.			324.61
Temperature range, max.			540.56
η	0.0017431	Pa×s	324.61	Calculated Property
η	0.0011842	Pa×s	348.60	Calculated Property
η	0.0008456	Pa×s	372.60	Calculated Property
η	0.0006289	Pa×s	396.59	Calculated Property
η	0.0004838	Pa×s	420.59	Calculated Property
η	0.0003829	Pa×s	444.58	Calculated Property
η	0.0003104	Pa×s	468.58	Calculated Property
η	0.0002568	Pa×s	492.57	Calculated Property
η	0.0002162	Pa×s	516.56	Calculated Property
η	0.0001849	Pa×s	540.56	Calculated Property

Similar Compounds

Find more compounds similar to Carbonic acid, ethyl 4-chlorophenyl 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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