Chemical Properties of Fumaric acid, 2-chloro-5-methylphenyl dodecyl ester

Fumaric acid, 2-chloro-5-methylphenyl dodecyl ester

InChI
InChI=1S/C23H33ClO4/c1-3-4-5-6-7-8-9-10-11-12-17-27-22(25)15-16-23(26)28-21-18-19(2)13-14-20(21)24/h13-16,18H,3-12,17H2,1-2H3/b16-15+
InChI Key
PKAHTTPOKHAOIZ-FOCLMDBBSA-N
Formula
C23H33ClO4
SMILES
CCCCCCCCCCCCOC(=O)C=CC(=O)Oc1cc(C)ccc1Cl
Molecular Weight1
408.96
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Physical Properties

Property Value Unit Source
ΔfusH° 58.56 kJ/mol Joback Calculated Property
logPoct/wat 6.574 Crippen Calculated Property
McVol 333.990 ml/mol McGowan Calculated Property
Inp [2973.00; 2973.00]   Show Hide
Inp 2973.00 NIST
Inp 2973.00 NIST
Tboil 653.68 K Relay (1.0) Calculated Property
Tfus 321.09 K Relay (1.0) Calculated Property

Cheméo can also estimate 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, 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 [1055.83; 1129.52] J/mol×K [956.45; 1172.53] Show Hide
Cp,gas 1055.83 J/mol×K 956.45 Joback Calculated Property
Cp,gas 1071.02 J/mol×K 992.46 Joback Calculated Property
Cp,gas 1084.98 J/mol×K 1028.48 Joback Calculated Property
Cp,gas 1097.77 J/mol×K 1064.49 Joback Calculated Property
Cp,gas 1109.42 J/mol×K 1100.50 Joback Calculated Property
Cp,gas 1119.99 J/mol×K 1136.51 Joback Calculated Property
Cp,gas 1129.52 J/mol×K 1172.53 Joback Calculated Property
η [0.0000271; 0.0002810] Pa×s [569.59; 956.45] Show Hide
η 0.0002810 Pa×s 569.59 Joback Calculated Property
η 0.0001561 Pa×s 634.07 Joback Calculated Property
η 0.0000967 Pa×s 698.54 Joback Calculated Property
η 0.0000649 Pa×s 763.02 Joback Calculated Property
η 0.0000464 Pa×s 827.50 Joback Calculated Property
η 0.0000348 Pa×s 891.97 Joback Calculated Property
η 0.0000271 Pa×s 956.45 Joback Calculated Property

Similar Compounds

Fumaric acid, 2-chloro-5-methylphenyl tridecyl ester. Fumaric acid, 2-chloro-5-methylphenyl nonyl ester. Fumaric acid, 2-chloro-5-methylphenyl pentadecyl ester. Fumaric acid, 2-chloro-5-methylphenyl undecyl ester. Fumaric acid, 2-chloro-5-methylphenyl hexyl ester. Fumaric acid, 2-chloro-5-methylphenyl pentyl ester. Fumaric acid, butyl 2-chloro-5-methylphenyl ester. Fumaric acid, 2-chloro-5-methylphenyl isohexyl ester. Fumaric acid, 2-chloro-5-methylphenyl propyl ester. Fumaric acid, 2-chloro-5-methylphenyl isobutyl ester. Fumaric acid, 2-chlorophenyl 8-chlorooctyl ester. Fumaric acid, 2-chloro-5-methylphenyl ethyl ester. Fumaric acid, 2,4-dichlorophenyl 8-chlorooctyl ester. Sebacic acid, 2-chloro-5-methylphenyl decyl ester. Sebacic acid, 2-chloro-5-methylphenyl undecyl ester.

Find more compounds similar to Fumaric acid, 2-chloro-5-methylphenyl dodecyl ester.

Sources

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