Chemical Properties of Diethylmalonic acid, di(1-phenylpropyl) ester

InChI

InChI=1S/C25H32O4/c1-5-21(19-15-11-9-12-16-19)28-23(26)25(7-3,8-4)24(27)29-22(6-2)20-17-13-10-14-18-20/h9-18,21-22H,5-8H2,1-4H3

InChI Key

PSQVCHZPWRKXTJ-UHFFFAOYSA-N

Formula

C25H32O4

SMILES

CCC(OC(=O)C(CC)(CC)C(=O)OC(CC)c1ccccc1)c1ccccc1

Molecular Weight¹

396.52

• 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).
• 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 vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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	[1066.44; 1136.65]	J/mol×K	[937.29; 1162.96]
Cp,gas	1066.44	J/mol×K	937.29	Joback Calculated Property
Cp,gas	1081.56	J/mol×K	974.90	Joback Calculated Property
Cp,gas	1095.19	J/mol×K	1012.51	Joback Calculated Property
Cp,gas	1107.42	J/mol×K	1050.13	Joback Calculated Property
Cp,gas	1118.35	J/mol×K	1087.74	Joback Calculated Property
Cp,gas	1128.06	J/mol×K	1125.35	Joback Calculated Property
Cp,gas	1136.65	J/mol×K	1162.96	Joback Calculated Property
η	[0.0000129; 0.0006179]	Pa×s	[481.43; 937.29]
η	0.0006179	Pa×s	481.43	Joback Calculated Property
η	0.0002091	Pa×s	557.41	Joback Calculated Property
η	0.0000918	Pa×s	633.38	Joback Calculated Property
η	0.0000480	Pa×s	709.36	Joback Calculated Property
η	0.0000285	Pa×s	785.34	Joback Calculated Property
η	0.0000185	Pa×s	861.31	Joback Calculated Property
η	0.0000129	Pa×s	937.29	Joback Calculated Property

Similar Compounds

Find more compounds similar to Diethylmalonic acid, di(1-phenylpropyl) 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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