Chemical Properties of Diethylmalonic acid, 2,6-dimethoxyphenyl nonyl ester

InChI

InChI=1S/C24H38O6/c1-6-9-10-11-12-13-14-18-29-22(25)24(7-2,8-3)23(26)30-21-19(27-4)16-15-17-20(21)28-5/h15-17H,6-14,18H2,1-5H3

InChI Key

YAWOELZFWWBZEX-UHFFFAOYSA-N

Formula

C24H38O6

SMILES

CCCCCCCCCOC(=O)C(CC)(CC)C(=O)Oc1c(OC)cccc1OC

Molecular Weight¹

422.56

• 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	[524.48; 1187.59]	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			5.31100e+01
Coefficient B			1.97580e+00
Coefficient C			-9.39520e-04
Coefficient D			9.82000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	524.48	J/mol×K	273.00	Calculated Property
Cp,gas	638.86	J/mol×K	353.78	Calculated Property
Cp,gas	742.35	J/mol×K	434.56	Calculated Property
Cp,gas	835.24	J/mol×K	515.33	Calculated Property
Cp,gas	917.85	J/mol×K	596.11	Calculated Property
Cp,gas	990.49	J/mol×K	676.89	Calculated Property
Cp,gas	1053.48	J/mol×K	757.67	Calculated Property
Cp,gas	1107.12	J/mol×K	838.44	Calculated Property
Cp,gas	1151.72	J/mol×K	919.22	Calculated Property
Cp,gas	1187.59	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0001885; 0.0000194]	Pa×s	[543.24; 808.86]	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			-1.55077e+01
Coefficient B			3.76534e+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.			543.24
Temperature range, max.			808.86
η	0.0001885	Pa×s	543.24	Calculated Property
η	0.0001319	Pa×s	572.75	Calculated Property
η	0.0000956	Pa×s	602.27	Calculated Property
η	0.0000714	Pa×s	631.78	Calculated Property
η	0.0000547	Pa×s	661.29	Calculated Property
η	0.0000429	Pa×s	690.80	Calculated Property
η	0.0000343	Pa×s	720.32	Calculated Property
η	0.0000279	Pa×s	749.83	Calculated Property
η	0.0000231	Pa×s	779.34	Calculated Property
η	0.0000194	Pa×s	808.86	Calculated Property

Similar Compounds

Find more compounds similar to Diethylmalonic acid, 2,6-dimethoxyphenyl nonyl ester.

Sources

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

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