Chemical Properties of Diethylmalonic acid, 2-isopropylphenyl undecyl ester

InChI

InChI=1S/C27H44O4/c1-6-9-10-11-12-13-14-15-18-21-30-25(28)27(7-2,8-3)26(29)31-24-20-17-16-19-23(24)22(4)5/h16-17,19-20,22H,6-15,18,21H2,1-5H3

InChI Key

NHHVZNXFZIMRIR-UHFFFAOYSA-N

Formula

C27H44O4

SMILES

CCCCCCCCCCCOC(=O)C(CC)(CC)C(=O)Oc1ccccc1C(C)C

Molecular Weight¹

432.64

• 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1306.64; 1392.33]	J/mol×K	[997.73; 1221.62]
Cp,gas	1306.64	J/mol×K	997.73	Joback Calculated Property
Cp,gas	1324.38	J/mol×K	1035.04	Joback Calculated Property
Cp,gas	1340.63	J/mol×K	1072.36	Joback Calculated Property
Cp,gas	1355.47	J/mol×K	1109.67	Joback Calculated Property
Cp,gas	1368.98	J/mol×K	1146.99	Joback Calculated Property
Cp,gas	1381.24	J/mol×K	1184.30	Joback Calculated Property
Cp,gas	1392.33	J/mol×K	1221.62	Joback Calculated Property
η	[0.0000134; 0.0002587]	Pa×s	[564.73; 997.73]
η	0.0002587	Pa×s	564.73	Joback Calculated Property
η	0.0001195	Pa×s	636.90	Joback Calculated Property
η	0.0000646	Pa×s	709.06	Joback Calculated Property
η	0.0000391	Pa×s	781.23	Joback Calculated Property
η	0.0000258	Pa×s	853.40	Joback Calculated Property
η	0.0000181	Pa×s	925.56	Joback Calculated Property
η	0.0000134	Pa×s	997.73	Joback Calculated Property

Similar Compounds

Find more compounds similar to Diethylmalonic acid, 2-isopropylphenyl undecyl ester.

Sources

• Cheméo Relay (1.0)
• 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.