Chemical Properties of Carbonic acid, ethyl cyclohexyl ester

InChI

InChI=1S/C9H16O3/c1-2-11-9(10)12-8-6-4-3-5-7-8/h8H,2-7H2,1H3

InChI Key

XSSAWOIEQNZRDP-UHFFFAOYSA-N

Formula

C9H16O3

SMILES

CCOC(=O)OC1CCCCC1

Molecular Weight¹

172.22

• 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).
• 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, Ionization energy 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	[190.03; 495.33]	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			-1.99890e+01
Coefficient B			8.62920e-01
Coefficient C			-3.41200e-04
Coefficient D			-6.40000e-09
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	190.03	J/mol×K	273.00	Calculated Property
Cp,gas	242.31	J/mol×K	353.78	Calculated Property
Cp,gas	290.04	J/mol×K	434.56	Calculated Property
Cp,gas	333.21	J/mol×K	515.33	Calculated Property
Cp,gas	371.81	J/mol×K	596.11	Calculated Property
Cp,gas	405.80	J/mol×K	676.89	Calculated Property
Cp,gas	435.16	J/mol×K	757.67	Calculated Property
Cp,gas	459.89	J/mol×K	838.44	Calculated Property
Cp,gas	479.95	J/mol×K	919.22	Calculated Property
Cp,gas	495.33	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0052768; 0.0002140]	Pa×s	[263.13; 496.58]	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			-1.20622e+01
Coefficient B			1.79396e+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.			263.13
Temperature range, max.			496.58
η	0.0052768	Pa×s	263.13	Calculated Property
η	0.0028620	Pa×s	289.07	Calculated Property
η	0.0017169	Pa×s	315.01	Calculated Property
η	0.0011132	Pa×s	340.95	Calculated Property
η	0.0007674	Pa×s	366.89	Calculated Property
η	0.0005556	Pa×s	392.83	Calculated Property
η	0.0004187	Pa×s	418.77	Calculated Property
η	0.0003261	Pa×s	444.71	Calculated Property
η	0.0002611	Pa×s	470.64	Calculated Property
η	0.0002140	Pa×s	496.58	Calculated Property

Similar Compounds

Find more compounds similar to Carbonic acid, ethyl cyclohexyl 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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