Chemical Properties of Diethylmalonic acid, hexyl 2-isopropylphenyl ester

Diethylmalonic acid, hexyl 2-isopropylphenyl ester

InChI
InChI=1S/C22H34O4/c1-6-9-10-13-16-25-20(23)22(7-2,8-3)21(24)26-19-15-12-11-14-18(19)17(4)5/h11-12,14-15,17H,6-10,13,16H2,1-5H3
InChI Key
CSZMWHHDFPSNCL-UHFFFAOYSA-N
Formula
C22H34O4
SMILES
CCCCCCOC(=O)C(CC)(CC)C(=O)Oc1ccccc1C(C)C
Molecular Weight1
362.50
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Physical Properties

Property Value Unit Source
ΔfusH° 44.19 kJ/mol Joback Calculated Property
log10WS -5.36 Relay (1.0) Calculated Property
logPoct/wat 5.645 Crippen Calculated Property
McVol 311.960 ml/mol McGowan Calculated Property
Pc 1128.35 kPa Joback Calculated Property
Inp 2220.00 NIST
Tboil 617.32 K Relay (1.0) Calculated Property
Tfus 298.75 K Relay (1.0) Calculated Property

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 [984.19; 1067.63] J/mol×K [847.39; 1050.04] Show Hide
Cp,gas 984.19 J/mol×K 847.39 Joback Calculated Property
Cp,gas 1001.20 J/mol×K 881.17 Joback Calculated Property
Cp,gas 1016.90 J/mol×K 914.94 Joback Calculated Property
Cp,gas 1031.35 J/mol×K 948.72 Joback Calculated Property
Cp,gas 1044.58 J/mol×K 982.49 Joback Calculated Property
Cp,gas 1056.66 J/mol×K 1016.27 Joback Calculated Property
Cp,gas 1067.63 J/mol×K 1050.04 Joback Calculated Property
η [0.0000230; 0.0008309] Pa×s [448.72; 847.39] Show Hide
η 0.0008309 Pa×s 448.72 Joback Calculated Property
η 0.0003107 Pa×s 515.16 Joback Calculated Property
η 0.0001455 Pa×s 581.61 Joback Calculated Property
η 0.0000796 Pa×s 648.05 Joback Calculated Property
η 0.0000487 Pa×s 714.50 Joback Calculated Property
η 0.0000324 Pa×s 780.94 Joback Calculated Property
η 0.0000230 Pa×s 847.39 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, 2-isopropylphenyl octyl ester. Diethylmalonic acid, 2-isopropylphenyl tridecyl ester. Diethylmalonic acid, decyl 2-isopropylphenyl ester. Diethylmalonic acid, dodecyl 2-isopropylphenyl ester. Diethylmalonic acid, 2-isopropylphenyl octadecyl ester. Diethylmalonic acid, heptyl 2-isopropylphenyl ester. Diethylmalonic acid, 2-isopropylphenyl tetradecyl ester. Diethylmalonic acid, 2-isopropylphenyl nonyl ester. Diethylmalonic acid, hexadecyl 2-isopropylphenyl ester. Diethylmalonic acid, heptadecyl 2-isopropylphenyl ester. Diethylmalonic acid, 2-isopropylphenyl undecyl ester. Diethylmalonic acid, 2-isopropylphenyl pentadecyl ester. Diethylmalonic acid, 2-isopropylphenyl pentyl ester. Diethylmalonic acid, butyl 2-isopropylphenyl ester. Diethylmalonic acid, 2-isopropylphenyl propyl ester.

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

Sources

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