Chemical Properties of Fumaric acid, dodecyl 3-oxobut-2-yl ester

Fumaric acid, dodecyl 3-oxobut-2-yl ester

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InChI
InChI=1S/C20H34O5/c1-4-5-6-7-8-9-10-11-12-13-16-24-19(22)14-15-20(23)25-18(3)17(2)21/h14-15,18H,4-13,16H2,1-3H3/b15-14+
InChI Key
TYYXXOUHSFLVKB-CCEZHUSRSA-N
Formula
C20H34O5
SMILES
CCCCCCCCCCCCOC(=O)C=CC(=O)OC(C)C(C)=O
Molecular Weight1
354.48
Sources

Physical Properties

Property Value Unit Source
Δf -401.46 kJ/mol Joback Calculated Property
Δfgas -946.37 kJ/mol Joback Calculated Property
Δfus 51.41 kJ/mol Joback Calculated Property
Δvap 84.74 kJ/mol Joback Calculated Property
logPoct/wat 4.53 Crippen Calculated Property
Pc 1170.42 kPa Joback Calculated Property
Tboil 867.17 K Joback Calculated Property
Tc 1064.01 K Joback Calculated Property
Tfus 489.33 K Joback Calculated Property
Vc 1.18 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 965.67 J/mol×K 867.17 Joback Calculated Property
η 0.00 Pa×s 867.17 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
-CH3 3
-CH2- 11
=CH- 2
>C=O (nonring) 3

Similar Compounds

Fumaric acid, octyl 3-oxobut-2-yl ester. Fumaric acid, nonyl 3-oxobut-2-yl ester. Fumaric acid, 3-oxobut-2-yl tetradecyl ester. Fumaric acid, nonadecyl 3-oxobut-2-yl ester. Fumaric acid, 3-oxobut-2-yl pentadecyl ester. Fumaric acid, decyl 3-oxobut-2-yl ester. Fumaric acid, 3-oxobut-2-yl undecyl ester. Fumaric acid, hexadecyl 3-oxobut-2-yl ester. Fumaric acid, heptadecyl 3-oxobut-2-yl ester. Fumaric acid, octadecyl 3-oxobut-2-yl ester. Fumaric acid, 3-oxobut-2-yl tridecyl ester. Fumaric acid, eicosyl 3-oxobut-2-yl ester. Fumaric acid, heptyl 3-oxobut-2-yl ester. Fumaric acid, hexyl 3-oxobut-2-yl ester. Fumaric acid, butyl 3-oxobut-2-yl ester.

Find more compounds similar to Fumaric acid, dodecyl 3-oxobut-2-yl ester.

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