Chemical Properties of Diethylmalonic acid, 2,2-dichloroethyl nonyl ester

InChI

InChI=1S/C18H32Cl2O4/c1-4-7-8-9-10-11-12-13-23-16(21)18(5-2,6-3)17(22)24-14-15(19)20/h15H,4-14H2,1-3H3

InChI Key

GDGLHRYDEAUTSE-UHFFFAOYSA-N

Formula

C18H32Cl2O4

SMILES

CCCCCCCCCOC(=O)C(CC)(CC)C(=O)OCC(Cl)Cl

Molecular Weight¹

383.36

• 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).
• P_c : Critical Pressure (kPa).
• 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 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	[445.04; 982.73]	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			3.69710e+01
Coefficient B			1.74956e+00
Coefficient C			-9.82000e-04
Coefficient D			1.78200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	445.04	J/mol×K	273.00	Calculated Property
Cp,gas	540.91	J/mol×K	353.78	Calculated Property
Cp,gas	626.44	J/mol×K	434.56	Calculated Property
Cp,gas	702.18	J/mol×K	515.33	Calculated Property
Cp,gas	768.70	J/mol×K	596.11	Calculated Property
Cp,gas	826.56	J/mol×K	676.89	Calculated Property
Cp,gas	876.34	J/mol×K	757.67	Calculated Property
Cp,gas	918.58	J/mol×K	838.44	Calculated Property
Cp,gas	953.86	J/mol×K	919.22	Calculated Property
Cp,gas	982.73	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0013034; 0.0000587]	Pa×s	[424.54; 691.97]	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			-1.46650e+01
Coefficient B			3.40576e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			424.54
Temperature range, max.			691.97
η	0.0013034	Pa×s	424.54	Calculated Property
η	0.0007712	Pa×s	454.25	Calculated Property
η	0.0004867	Pa×s	483.97	Calculated Property
η	0.0003239	Pa×s	513.68	Calculated Property
η	0.0002254	Pa×s	543.40	Calculated Property
η	0.0001629	Pa×s	573.11	Calculated Property
η	0.0001215	Pa×s	602.83	Calculated Property
η	0.0000932	Pa×s	632.54	Calculated Property
η	0.0000732	Pa×s	662.26	Calculated Property
η	0.0000587	Pa×s	691.97	Calculated Property

Similar Compounds

Find more compounds similar to Diethylmalonic acid, 2,2-dichloroethyl nonyl ester.

Sources

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

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