Chemical Properties of Pimelic acid, 4-methyl-2-pentyl 2-methylphenyl ester

Pimelic acid, 4-methyl-2-pentyl 2-methylphenyl ester

InChI
InChI=1S/C20H30O4/c1-15(2)14-17(4)23-19(21)12-6-5-7-13-20(22)24-18-11-9-8-10-16(18)3/h8-11,15,17H,5-7,12-14H2,1-4H3
InChI Key
URGYYFZCTPGLCK-UHFFFAOYSA-N
Formula
C20H30O4
SMILES
Cc1ccccc1OC(=O)CCCCCC(=O)OC(C)CC(C)C
Molecular Weight1
334.45
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Physical Properties

Property Value Unit Source
ΔfusH° 42.90 kJ/mol Joback Calculated Property
IE 8.45 eV Relay (1.0) Calculated Property
logPoct/wat 4.829 Crippen Calculated Property
McVol 283.780 ml/mol McGowan Calculated Property
Inp [2352.00; 2352.00]   Show Hide
Inp 2352.00 NIST
Inp 2352.00 NIST
Tboil 618.00 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, 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 [865.32; 947.87] J/mol×K [804.42; 1003.21] Show Hide
Cp,gas 865.32 J/mol×K 804.42 Joback Calculated Property
Cp,gas 882.09 J/mol×K 837.55 Joback Calculated Property
Cp,gas 897.62 J/mol×K 870.68 Joback Calculated Property
Cp,gas 911.95 J/mol×K 903.81 Joback Calculated Property
Cp,gas 925.08 J/mol×K 936.94 Joback Calculated Property
Cp,gas 937.05 J/mol×K 970.08 Joback Calculated Property
Cp,gas 947.87 J/mol×K 1003.21 Joback Calculated Property
η [0.0000359; 0.0013786] Pa×s [408.76; 804.42] Show Hide
η 0.0013786 Pa×s 408.76 Joback Calculated Property
η 0.0004922 Pa×s 474.70 Joback Calculated Property
η 0.0002259 Pa×s 540.65 Joback Calculated Property
η 0.0001228 Pa×s 606.59 Joback Calculated Property
η 0.0000752 Pa×s 672.53 Joback Calculated Property
η 0.0000503 Pa×s 738.48 Joback Calculated Property
η 0.0000359 Pa×s 804.42 Joback Calculated Property

Similar Compounds

Glutaric acid, hept-2-yl 2-methylphenyl ester. Glutaric acid, dec-2-yl 2-methylphenyl ester. Glutaric acid, 2-methylpent-3-yl 2-methylphenyl ester. Sebacic acid, isohexyl 2-methylphenyl ester. Pimelic acid, 4-chloro-3-methylphenyl 4-methyl-2-pentyl ester. Glutaric acid, hept-2-yl 2-methyl-4-chlorophenyl ester. Glutaric acid, dec-2-yl 2-methyl-4-chlorophenyl ester. Succinic acid, 2-methylpent-3-yl 2-methylphenyl ester. Glutaric acid, 3-methylbut-2-yl 2-methylphenyl ester. Glutaric acid, 2-methylpent-3-yl 2-methyl-4-chlorophenyl ester. Succinic acid, dec-2-yl 4-chloro-2-methylphenyl ester. Succinic acid, hept-2-yl 4-chloro-2-methylphenyl ester. Sebacic acid, 4-chloro-2-methylphenyl isohexyl ester. Glutaric acid, 2-ethylhexyl 2-methylphenyl ester. Succinic acid, 2-methylpent-3-yl 4-chloro-2-methylphenyl ester.

Find more compounds similar to Pimelic acid, 4-methyl-2-pentyl 2-methylphenyl ester.

Sources

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