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

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

InChI
InChI=1S/C16H19ClO4/c1-3-4-5-10-20-15(18)8-9-16(19)21-14-11-12(2)6-7-13(14)17/h6-9,11H,3-5,10H2,1-2H3/b9-8+
InChI Key
LRSWQFVWJUANNJ-CMDGGOBGSA-N
Formula
C16H19ClO4
SMILES
CCCCCOC(=O)/C=C/C(=O)Oc1cc(C)ccc1Cl
Molecular Weight1
310.78
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Physical Properties

Property Value Unit Source
ΔfH°gas -702.81 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 43.60 kJ/mol Joback Calculated Property
ΔvapH° 98.72 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 3.843 Crippen Calculated Property
McVol 235.360 ml/mol McGowan Calculated Property
Tboil 606.93 K Relay (1.0) Calculated Property
Tfus 321.62 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, 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 [639.64; 706.94] J/mol×K [760.35; 968.76] Show Hide
Cp,gas 639.64 J/mol×K 760.35 Joback Calculated Property
Cp,gas 653.35 J/mol×K 795.08 Joback Calculated Property
Cp,gas 666.03 J/mol×K 829.82 Joback Calculated Property
Cp,gas 677.71 J/mol×K 864.55 Joback Calculated Property
Cp,gas 688.40 J/mol×K 899.29 Joback Calculated Property
Cp,gas 698.14 J/mol×K 934.02 Joback Calculated Property
Cp,gas 706.94 J/mol×K 968.76 Joback Calculated Property
η [0.0000566; 0.0008324] Pa×s [431.04; 760.35] Show Hide
η 0.0008324 Pa×s 431.04 Joback Calculated Property
η 0.0004130 Pa×s 485.93 Joback Calculated Property
η 0.0002362 Pa×s 540.81 Joback Calculated Property
η 0.0001498 Pa×s 595.69 Joback Calculated Property
η 0.0001025 Pa×s 650.58 Joback Calculated Property
η 0.0000745 Pa×s 705.46 Joback Calculated Property
η 0.0000566 Pa×s 760.35 Joback Calculated Property

Similar Compounds

Fumaric acid, 2-chloro-5-methylphenyl hexyl ester. Fumaric acid, 2-chloro-5-methylphenyl tridecyl ester. Fumaric acid, 2-chloro-5-methylphenyl undecyl ester. Fumaric acid, 2-chloro-5-methylphenyl dodecyl ester. Fumaric acid, 2-chloro-5-methylphenyl pentadecyl ester. Fumaric acid, 2-chloro-5-methylphenyl nonyl 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-chloro-5-methylphenyl ethyl ester. Fumaric acid, 2-chlorophenyl 8-chlorooctyl ester. Fumaric acid, 2,4-dichlorophenyl 8-chlorooctyl ester. Sebacic acid, 2-chloro-5-methylphenyl nonyl ester. Adipic acid, 2-chloro-5-methylphenyl heptyl ester.

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

Sources

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