Chemical Properties of Diethylmalonic acid, 2-fluorophenyl hexadecyl ester

Diethylmalonic acid, 2-fluorophenyl hexadecyl ester

InChI
InChI=1S/C29H47FO4/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-21-24-33-27(31)29(5-2,6-3)28(32)34-26-23-20-19-22-25(26)30/h19-20,22-23H,4-18,21,24H2,1-3H3
InChI Key
MFWJPWLMTCLSKL-UHFFFAOYSA-N
Formula
C29H47FO4
SMILES
CCCCCCCCCCCCCCCCOC(=O)C(CC)(CC)C(=O)Oc1ccccc1F
Molecular Weight1
478.68
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Physical Properties

Property Value Unit Source
ΔfusH° 68.92 kJ/mol Joback Calculated Property
log10WS -7.88 Relay (1.0) Calculated Property
logPoct/wat 8.562 Crippen Calculated Property
McVol 412.360 ml/mol McGowan Calculated Property
Pc 729.67 kPa Joback Calculated Property
Inp [3113.00; 3113.00]   Show Hide
Inp 3113.00 NIST
Inp 3113.00 NIST
Tboil 670.66 K Relay (1.0) Calculated Property
Tfus 317.75 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 [1422.31; 1508.24] J/mol×K [1007.26; 1238.01] Show Hide
Cp,gas 1422.31 J/mol×K 1007.26 Joback Calculated Property
Cp,gas 1440.60 J/mol×K 1045.72 Joback Calculated Property
Cp,gas 1457.17 J/mol×K 1084.18 Joback Calculated Property
Cp,gas 1472.12 J/mol×K 1122.63 Joback Calculated Property
Cp,gas 1485.55 J/mol×K 1161.09 Joback Calculated Property
Cp,gas 1497.55 J/mol×K 1199.55 Joback Calculated Property
Cp,gas 1508.24 J/mol×K 1238.01 Joback Calculated Property

Similar Compounds

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

Find more compounds similar to Diethylmalonic acid, 2-fluorophenyl hexadecyl ester.

Sources

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