Chemical Properties of DIETHYL DIBUTYLMALONATE

InChI

InChI=1S/C15H28O4/c1-5-9-11-15(12-10-6-2,13(16)18-7-3)14(17)19-8-4/h5-12H2,1-4H3

InChI Key

WHKKUUPZLWUOIW-UHFFFAOYSA-N

Formula

C15H28O4

SMILES

CCCCC(CCCC)(C(=O)OCC)C(=O)OCC

Molecular Weight¹

272.38

Other Names

• Malonic acid, dibutyl-, diethyl ester

• 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).
• IE : Ionization energy (eV).
• 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).
• 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 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	[354.90; 810.88]	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			1.55980e+01
Coefficient B			1.44508e+00
Coefficient C			-7.74800e-04
Coefficient D			1.25000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	354.90	J/mol×K	273.00	Calculated Property
Cp,gas	435.40	J/mol×K	353.78	Calculated Property
Cp,gas	507.51	J/mol×K	434.56	Calculated Property
Cp,gas	571.64	J/mol×K	515.33	Calculated Property
Cp,gas	628.18	J/mol×K	596.11	Calculated Property
Cp,gas	677.53	J/mol×K	676.89	Calculated Property
Cp,gas	720.07	J/mol×K	757.67	Calculated Property
Cp,gas	756.22	J/mol×K	838.44	Calculated Property
Cp,gas	786.35	J/mol×K	919.22	Calculated Property
Cp,gas	810.88	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0031573; 0.0001252]	Pa×s	[345.89; 583.33]	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			-1.36878e+01
Coefficient B			2.74282e+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.			345.89
Temperature range, max.			583.33
η	0.0031573	Pa×s	345.89	Calculated Property
η	0.0018000	Pa×s	372.27	Calculated Property
η	0.0011054	Pa×s	398.65	Calculated Property
η	0.0007212	Pa×s	425.04	Calculated Property
η	0.0004946	Pa×s	451.42	Calculated Property
η	0.0003536	Pa×s	477.80	Calculated Property
η	0.0002619	Pa×s	504.18	Calculated Property
η	0.0001998	Pa×s	530.56	Calculated Property
η	0.0001564	Pa×s	556.94	Calculated Property
η	0.0001252	Pa×s	583.33	Calculated Property

Similar Compounds

Find more compounds similar to DIETHYL DIBUTYLMALONATE.

Sources

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

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