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

InChI

InChI=1S/C11H19Cl3O3/c1-3-5-6-9(4-2)7-16-10(15)17-8-11(12,13)14/h9H,3-8H2,1-2H3

InChI Key

LBTHIGOEGDVVOW-UHFFFAOYSA-N

Formula

C11H19Cl3O3

SMILES

CCCCC(CC)COC(=O)OCC(Cl)(Cl)Cl

Molecular Weight¹

305.63

• 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).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• 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 Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, 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	[309.01; 640.26]	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			5.63160e+01
Coefficient B			1.08294e+00
Coefficient C			-6.05200e-04
Coefficient D			1.06200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	309.01	J/mol×K	273.00	Calculated Property
Cp,gas	368.39	J/mol×K	353.78	Calculated Property
Cp,gas	421.34	J/mol×K	434.56	Calculated Property
Cp,gas	468.20	J/mol×K	515.33	Calculated Property
Cp,gas	509.31	J/mol×K	596.11	Calculated Property
Cp,gas	544.99	J/mol×K	676.89	Calculated Property
Cp,gas	575.59	J/mol×K	757.67	Calculated Property
Cp,gas	601.45	J/mol×K	838.44	Calculated Property
Cp,gas	622.89	J/mol×K	919.22	Calculated Property
Cp,gas	640.26	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0025908; 0.0001401]	Pa×s	[355.47; 583.99]	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			-1.34116e+01
Coefficient B			2.65033e+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.			355.47
Temperature range, max.			583.99
η	0.0025908	Pa×s	355.47	Calculated Property
η	0.0015760	Pa×s	380.86	Calculated Property
η	0.0010202	Pa×s	406.25	Calculated Property
η	0.0006951	Pa×s	431.64	Calculated Property
η	0.0004942	Pa×s	457.03	Calculated Property
η	0.0003642	Pa×s	482.42	Calculated Property
η	0.0002767	Pa×s	507.81	Calculated Property
η	0.0002158	Pa×s	533.21	Calculated Property
η	0.0001722	Pa×s	558.60	Calculated Property
η	0.0001401	Pa×s	583.99	Calculated Property

Similar Compounds

Find more compounds similar to Carbonic acid, 2,2,2-trichloroethyl 2-ethylhexyl ester.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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