Chemical Properties of Diethylmalonic acid, 3-chlorobenzyl octyl ester

Diethylmalonic acid, 3-chlorobenzyl octyl ester

InChI
InChI=1S/C22H33ClO4/c1-4-7-8-9-10-11-15-26-20(24)22(5-2,6-3)21(25)27-17-18-13-12-14-19(23)16-18/h12-14,16H,4-11,15,17H2,1-3H3
InChI Key
FZVBSIBEIRYJKP-UHFFFAOYSA-N
Formula
C22H33ClO4
SMILES
CCCCCCCCOC(=O)C(CC)(CC)C(=O)OCc1cccc(Cl)c1
Molecular Weight1
396.95
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Physical Properties

Property Value Unit Source
ΔfusH° 51.91 kJ/mol Joback Calculated Property
log10WS -6.17 Relay (1.0) Calculated Property
logPoct/wat 6.093 Crippen Calculated Property
McVol 324.200 ml/mol McGowan Calculated Property
Pc 1094.99 kPa Joback Calculated Property
Inp 2544.00 NIST
Tboil 647.99 K Relay (1.0) Calculated Property
Tfus 280.48 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 [1011.62; 1087.04] J/mol×K [885.26; 1091.61] Show Hide
Cp,gas 1011.62 J/mol×K 885.26 Joback Calculated Property
Cp,gas 1027.20 J/mol×K 919.65 Joback Calculated Property
Cp,gas 1041.50 J/mol×K 954.04 Joback Calculated Property
Cp,gas 1054.59 J/mol×K 988.43 Joback Calculated Property
Cp,gas 1066.50 J/mol×K 1022.82 Joback Calculated Property
Cp,gas 1077.30 J/mol×K 1057.22 Joback Calculated Property
Cp,gas 1087.04 J/mol×K 1091.61 Joback Calculated Property
η [0.0000210; 0.0005076] Pa×s [493.64; 885.26] Show Hide
η 0.0005076 Pa×s 493.64 Joback Calculated Property
η 0.0002189 Pa×s 558.91 Joback Calculated Property
η 0.0001126 Pa×s 624.18 Joback Calculated Property
η 0.0000656 Pa×s 689.45 Joback Calculated Property
η 0.0000420 Pa×s 754.72 Joback Calculated Property
η 0.0000289 Pa×s 819.99 Joback Calculated Property
η 0.0000210 Pa×s 885.26 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, 3-chlorobenzyl dodecyl ester. Diethylmalonic acid, 3-chlorobenzyl heptadecyl ester. Diethylmalonic acid, 3-chlorobenzyl heptyl ester. Diethylmalonic acid, 3-chlorobenzyl tridecyl ester. Diethylmalonic acid, 3-chlorobenzyl nonyl ester. Diethylmalonic acid, 3-chlorobenzyl tetradecyl ester. Diethylmalonic acid, 3-chlorobenzyl undecyl ester. Diethylmalonic acid, 3-chlorobenzyl hexadecyl ester. Diethylmalonic acid, 3-chlorobenzyl pentadecyl ester. Diethylmalonic acid, 3-chlorobenzyl hexyl ester. Diethylmalonic acid, 3-chlorobenzyl pentyl ester. Diethylmalonic acid, butyl 3-chlorobenzyl ester. Diethylmalonic acid, 3-chlorobenzyl propyl ester. Diethylmalonic acid, 4-chlorobenzyl nonyl ester. Diethylmalonic acid, 4-chlorobenzyl dodecyl ester.

Find more compounds similar to Diethylmalonic acid, 3-chlorobenzyl octyl ester.

Sources

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