Chemical Properties of Fumaric acid, 3,5-dimethylphenyl hept-2-yl ester

Fumaric acid, 3,5-dimethylphenyl hept-2-yl ester

InChI
InChI=1S/C19H26O4/c1-5-6-7-8-16(4)22-18(20)9-10-19(21)23-17-12-14(2)11-15(3)13-17/h9-13,16H,5-8H2,1-4H3/b10-9+
InChI Key
JCARGHJGCCDSPX-MDZDMXLPSA-N
Formula
C19H26O4
SMILES
CCCCCC(C)OC(=O)C=CC(=O)Oc1cc(C)cc(C)c1
Molecular Weight1
318.41
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Physical Properties

Property Value Unit Source
ΔfusH° 43.65 kJ/mol Joback Calculated Property
logPoct/wat 4.277 Crippen Calculated Property
McVol 265.390 ml/mol McGowan Calculated Property
Inp [2296.00; 2296.00]   Show Hide
Inp 2296.00 NIST
Inp 2296.00 NIST
Tboil 605.92 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, 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 [780.93; 859.38] J/mol×K [791.12; 994.00] Show Hide
Cp,gas 780.93 J/mol×K 791.12 Joback Calculated Property
Cp,gas 796.76 J/mol×K 824.93 Joback Calculated Property
Cp,gas 811.46 J/mol×K 858.75 Joback Calculated Property
Cp,gas 825.04 J/mol×K 892.56 Joback Calculated Property
Cp,gas 837.53 J/mol×K 926.37 Joback Calculated Property
Cp,gas 848.97 J/mol×K 960.18 Joback Calculated Property
Cp,gas 859.38 J/mol×K 994.00 Joback Calculated Property
η [0.0000395; 0.0009257] Pa×s [419.93; 791.12] Show Hide
η 0.0009257 Pa×s 419.93 Joback Calculated Property
η 0.0003903 Pa×s 481.79 Joback Calculated Property
η 0.0002003 Pa×s 543.66 Joback Calculated Property
η 0.0001178 Pa×s 605.52 Joback Calculated Property
η 0.0000765 Pa×s 667.39 Joback Calculated Property
η 0.0000534 Pa×s 729.25 Joback Calculated Property
η 0.0000395 Pa×s 791.12 Joback Calculated Property

Similar Compounds

Fumaric acid, 3,5-dimethylphenyl 2-ethylhexyl ester. Fumaric acid, 3,5-dimethylphenyl 8-chlorooctyl ester. Fumaric acid, 3,5-dimethylphenyl cyclohexylmethyl ester. Fumaric acid, 2-octyl 3-chlorophenyl ester. Fumaric acid, 4-bromophenyl hept-2-yl ester. Fumaric acid, 4-methoxyphenyl hept-2-yl ester. Fumaric acid, 4-chlorophenyl hept-2-yl ester. Fumaric acid, naphth-2-yl hept-2-yl ester. Fumaric acid, naphth-2-yl dec-2-yl ester. Fumaric acid, 2-octyl 2-fluorophenyl ester. Fumaric acid, naphth-1-yl dec-2-yl ester. Fumaric acid, naphth-1-yl hept-2-yl ester. Fumaric acid, 2-chloro-5-methylphenyl undecyl ester. Fumaric acid, 2-chloro-5-methylphenyl nonyl ester. Fumaric acid, 2-chloro-5-methylphenyl tridecyl ester.

Find more compounds similar to Fumaric acid, 3,5-dimethylphenyl hept-2-yl ester.

Sources

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