Chemical Properties of Diethylmalonic acid, ethyl 2-hexyl ester

InChI

InChI=1S/C15H28O4/c1-6-10-11-12(5)19-14(17)15(7-2,8-3)13(16)18-9-4/h12H,6-11H2,1-5H3

InChI Key

DDBNJQZPLUIHMD-UHFFFAOYSA-N

Formula

C15H28O4

SMILES

CCCCC(C)OC(=O)C(CC)(CC)C(=O)OCC

Molecular Weight¹

272.38

• 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).
• IE : Ionization energy (eV).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[665.86; 755.74]	J/mol×K	[655.57; 835.49]
Cp,gas	665.86	J/mol×K	655.57	Joback Calculated Property
Cp,gas	683.12	J/mol×K	685.56	Joback Calculated Property
Cp,gas	699.44	J/mol×K	715.54	Joback Calculated Property
Cp,gas	714.84	J/mol×K	745.53	Joback Calculated Property
Cp,gas	729.35	J/mol×K	775.51	Joback Calculated Property
Cp,gas	742.97	J/mol×K	805.50	Joback Calculated Property
Cp,gas	755.74	J/mol×K	835.49	Joback Calculated Property
η	[0.0000691; 0.0044348]	Pa×s	[330.89; 655.57]
η	0.0044348	Pa×s	330.89	Joback Calculated Property
η	0.0013612	Pa×s	385.00	Joback Calculated Property
η	0.0005590	Pa×s	439.12	Joback Calculated Property
η	0.0002790	Pa×s	493.23	Joback Calculated Property
η	0.0001598	Pa×s	547.34	Joback Calculated Property
η	0.0001012	Pa×s	601.46	Joback Calculated Property
η	0.0000691	Pa×s	655.57	Joback Calculated Property

Similar Compounds

Find more compounds similar to Diethylmalonic acid, ethyl 2-hexyl 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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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