Chemical Properties of Sebacic acid, 3,5-dichlorophenyl isobutyl ester

Sebacic acid, 3,5-dichlorophenyl isobutyl ester

InChI
InChI=1S/C20H28Cl2O4/c1-15(2)14-25-19(23)9-7-5-3-4-6-8-10-20(24)26-18-12-16(21)11-17(22)13-18/h11-13,15H,3-10,14H2,1-2H3
InChI Key
GSQUOXUEROKAMJ-UHFFFAOYSA-N
Formula
C20H28Cl2O4
SMILES
CC(C)COC(=O)CCCCCCCCC(=O)Oc1cc(Cl)cc(Cl)c1
Molecular Weight1
403.35
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Physical Properties

Property Value Unit Source
ΔfH°gas -911.86 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 54.43 kJ/mol Joback Calculated Property
ΔvapH° 109.40 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 6.219 Crippen Calculated Property
McVol 308.260 ml/mol McGowan Calculated Property
Pc 1194.82 kPa Joback Calculated Property
Tboil 646.78 K Relay (1.0) Calculated Property
Tc 868.11 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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 [918.34; 983.47] J/mol×K [884.70; 1092.36] Show Hide
Cp,gas 918.34 J/mol×K 884.70 Joback Calculated Property
Cp,gas 932.25 J/mol×K 919.31 Joback Calculated Property
Cp,gas 944.90 J/mol×K 953.92 Joback Calculated Property
Cp,gas 956.32 J/mol×K 988.53 Joback Calculated Property
Cp,gas 966.54 J/mol×K 1023.14 Joback Calculated Property
Cp,gas 975.58 J/mol×K 1057.75 Joback Calculated Property
Cp,gas 983.47 J/mol×K 1092.36 Joback Calculated Property
η [0.0000286; 0.0005240] Pa×s [496.12; 884.70] Show Hide
η 0.0005240 Pa×s 496.12 Joback Calculated Property
η 0.0002440 Pa×s 560.88 Joback Calculated Property
η 0.0001331 Pa×s 625.65 Joback Calculated Property
η 0.0000813 Pa×s 690.41 Joback Calculated Property
η 0.0000541 Pa×s 755.17 Joback Calculated Property
η 0.0000384 Pa×s 819.94 Joback Calculated Property
η 0.0000286 Pa×s 884.70 Joback Calculated Property

Similar Compounds

Sebacic acid, isobutyl 3,4,5-trichlorophenyl ester. Sebacic acid, 3-chlorophenyl isobutyl ester. Glutaric acid, 3,5-dichlorophenyl isobutyl ester. Pimelic acid, 3-chlorophenyl isobutyl ester. Adipic acid, isobutyl 3,4,5-trichlorophenyl ester. Sebacic acid, butyl 3,5-dichlorophenyl ester. Sebacic acid, 3,5-dichlorophenyl pentyl ester. Pimelic acid, 3,4-dichlorophenyl isobutyl ester. Sebacic acid, 3,5-dichlorophenyl nonyl ester. Sebacic acid, 3,5-dichlorophenyl hexyl ester. Sebacic acid, 3,5-dichlorophenyl octyl ester. Sebacic acid, decyl 3,5-dichlorophenyl ester. Sebacic acid, 3,5-dichlorophenyl heptyl ester. Adipic acid, isobutyl 2,3,5-trichlorophenyl ester. Sebacic acid, 2,5-dichlorophenyl isobutyl ester.

Find more compounds similar to Sebacic acid, 3,5-dichlorophenyl isobutyl ester.

Sources

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