Chemical Properties of Adipic acid, 2-chloro-5-methylphenyl isobutyl ester

Adipic acid, 2-chloro-5-methylphenyl isobutyl ester

InChI
InChI=1S/C17H23ClO4/c1-12(2)11-21-16(19)6-4-5-7-17(20)22-15-10-13(3)8-9-14(15)18/h8-10,12H,4-7,11H2,1-3H3
InChI Key
PRIYAETYHQFLRD-UHFFFAOYSA-N
Formula
C17H23ClO4
SMILES
Cc1ccc(Cl)c(OC(=O)CCCCC(=O)OCC(C)C)c1
Molecular Weight1
326.81
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Physical Properties

Property Value Unit Source
ΔfH°gas -833.51 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 42.46 kJ/mol Joback Calculated Property
ΔvapH° 92.41 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 4.313 Crippen Calculated Property
McVol 253.750 ml/mol McGowan Calculated Property
Pc 1516.39 kPa Joback Calculated Property
Inp 2283.00 NIST
Tboil 617.42 K Relay (1.0) Calculated Property
Tc 829.91 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 [720.48; 792.34] J/mol×K [778.63; 982.19] Show Hide
Cp,gas 720.48 J/mol×K 778.63 Joback Calculated Property
Cp,gas 735.19 J/mol×K 812.56 Joback Calculated Property
Cp,gas 748.79 J/mol×K 846.48 Joback Calculated Property
Cp,gas 761.29 J/mol×K 880.41 Joback Calculated Property
Cp,gas 772.70 J/mol×K 914.34 Joback Calculated Property
Cp,gas 783.05 J/mol×K 948.26 Joback Calculated Property
Cp,gas 792.34 J/mol×K 982.19 Joback Calculated Property
η [0.0000523; 0.0009614] Pa×s [432.39; 778.63] Show Hide
η 0.0009614 Pa×s 432.39 Joback Calculated Property
η 0.0004448 Pa×s 490.10 Joback Calculated Property
η 0.0002421 Pa×s 547.80 Joback Calculated Property
η 0.0001479 Pa×s 605.51 Joback Calculated Property
η 0.0000985 Pa×s 663.22 Joback Calculated Property
η 0.0000700 Pa×s 720.92 Joback Calculated Property
η 0.0000523 Pa×s 778.63 Joback Calculated Property

Similar Compounds

Sebacic acid, 2-chloro-5-methylphenyl isobutyl ester. Glutaric acid, 2-chloro-5-methylphenyl isobutyl ester. Sebacic acid, 2-chloro-5-methylphenyl propyl ester. Adipic acid, butyl 2-chloro-5-methylphenyl ester. Adipic acid, 2-chloro-5-methylphenyl pentyl ester. Adipic acid, 2-chloro-5-methylphenyl hexyl ester. Sebacic acid, 2-chloro-5-methylphenyl undecyl ester. Sebacic acid, 2-chloro-5-methylphenyl nonyl ester. Adipic acid, 2-chloro-5-methylphenyl nonyl ester. Adipic acid, 2-chloro-5-methylphenyl dodecyl ester. Adipic acid, 2-chloro-5-methylphenyl undecyl ester. Sebacic acid, 2-chloro-5-methylphenyl octyl ester. Adipic acid, 2-chloro-5-methylphenyl decyl ester. Adipic acid, 2-chloro-5-methylphenyl octyl ester. Sebacic acid, 2-chloro-5-methylphenyl hexyl ester.

Find more compounds similar to Adipic acid, 2-chloro-5-methylphenyl isobutyl ester.

Sources

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