Chemical Properties of Carbonic acid, 2,2,2-trichloroethyl cyclohexyl ester

InChI

InChI=1S/C9H13Cl3O3/c10-9(11,12)6-14-8(13)15-7-4-2-1-3-5-7/h7H,1-6H2

InChI Key

MDNHFAMHCYNWIL-UHFFFAOYSA-N

Formula

C9H13Cl3O3

SMILES

O=C(OCC(Cl)(Cl)Cl)OC1CCCCC1

Molecular Weight¹

275.56

• 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_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, 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	[228.78; 521.61]	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			-5.78900e+00
Coefficient B			1.00910e+00
Coefficient C			-5.74200e-04
Coefficient D			9.25000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	228.78	J/mol×K	273.00	Calculated Property
Cp,gas	283.44	J/mol×K	353.78	Calculated Property
Cp,gas	331.88	J/mol×K	434.56	Calculated Property
Cp,gas	374.40	J/mol×K	515.33	Calculated Property
Cp,gas	411.30	J/mol×K	596.11	Calculated Property
Cp,gas	442.86	J/mol×K	676.89	Calculated Property
Cp,gas	469.38	J/mol×K	757.67	Calculated Property
Cp,gas	491.15	J/mol×K	838.44	Calculated Property
Cp,gas	508.46	J/mol×K	919.22	Calculated Property
Cp,gas	521.61	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0029214; 0.0001669]	Pa×s	[355.31; 591.27]	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			-1.30082e+01
Coefficient B			2.54846e+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.			355.31
Temperature range, max.			591.27
η	0.0029214	Pa×s	355.31	Calculated Property
η	0.0017846	Pa×s	381.53	Calculated Property
η	0.0011615	Pa×s	407.75	Calculated Property
η	0.0007962	Pa×s	433.96	Calculated Property
η	0.0005698	Pa×s	460.18	Calculated Property
η	0.0004227	Pa×s	486.40	Calculated Property
η	0.0003234	Pa×s	512.62	Calculated Property
η	0.0002539	Pa×s	538.83	Calculated Property
η	0.0002039	Pa×s	565.05	Calculated Property
η	0.0001669	Pa×s	591.27	Calculated Property

Similar Compounds

Find more compounds similar to Carbonic acid, 2,2,2-trichloroethyl 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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