Chemical Properties of Diethylmalonic acid, 3-fluorophenyl nonyl ester

Diethylmalonic acid, 3-fluorophenyl nonyl ester

InChI
InChI=1S/C22H33FO4/c1-4-7-8-9-10-11-12-16-26-20(24)22(5-2,6-3)21(25)27-19-15-13-14-18(23)17-19/h13-15,17H,4-12,16H2,1-3H3
InChI Key
WYLHMUXICRJGKO-UHFFFAOYSA-N
Formula
C22H33FO4
SMILES
CCCCCCCCCOC(=O)C(CC)(CC)C(=O)Oc1cccc(F)c1
Molecular Weight1
380.49
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Physical Properties

Property Value Unit Source
ΔfusH° 50.79 kJ/mol Joback Calculated Property
log10WS -6.19 Relay (1.0) Calculated Property
logPoct/wat 5.831 Crippen Calculated Property
McVol 313.730 ml/mol McGowan Calculated Property
Pc 1089.22 kPa Joback Calculated Property
Inp 2349.00 NIST
Tboil 633.77 K Relay (1.0) Calculated Property
Tfus 302.47 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 [991.01; 1072.32] J/mol×K [847.10; 1044.43] Show Hide
Cp,gas 991.01 J/mol×K 847.10 Joback Calculated Property
Cp,gas 1007.49 J/mol×K 879.99 Joback Calculated Property
Cp,gas 1022.74 J/mol×K 912.88 Joback Calculated Property
Cp,gas 1036.80 J/mol×K 945.77 Joback Calculated Property
Cp,gas 1049.72 J/mol×K 978.66 Joback Calculated Property
Cp,gas 1061.55 J/mol×K 1011.55 Joback Calculated Property
Cp,gas 1072.32 J/mol×K 1044.43 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, decyl 3-fluorophenyl ester. Diethylmalonic acid, dodecyl 3-fluorophenyl ester. Diethylmalonic acid, 3-fluorophenyl hexyl ester. Diethylmalonic acid, 3-fluorophenyl undecyl ester. Diethylmalonic acid, 3-fluorophenyl pentyl ester. Diethylmalonic acid, butyl 3-fluorophenyl ester. Diethylmalonic acid, 2-fluorophenyl nonyl ester. Diethylmalonic acid, 2-fluorophenyl hexadecyl ester. Diethylmalonic acid, 2-fluorophenyl pentadecyl ester. Diethylmalonic acid, 2-fluorophenyl hexyl ester. Diethylmalonic acid, 2-fluorophenyl octadecyl ester. Diethylmalonic acid, 2-fluorophenyl octyl ester. Diethylmalonic acid, 2-fluorophenyl heptyl ester. Diethylmalonic acid, 2-fluorophenyl tridecyl ester. Diethylmalonic acid, 2-fluorophenyl heptadecyl ester.

Find more compounds similar to Diethylmalonic acid, 3-fluorophenyl nonyl ester.

Sources

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