Chemical Properties of Fumaric acid, 2-butyl pentyl ester

Fumaric acid, 2-butyl pentyl ester

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InChI
InChI=1S/C13H22O4/c1-4-6-7-10-16-12(14)8-9-13(15)17-11(3)5-2/h8-9,11H,4-7,10H2,1-3H3/b9-8+
InChI Key
FKYWKWVYRJZSPT-CMDGGOBGSA-N
Formula
C13H22O4
SMILES
CCCCCOC(=O)C=CC(=O)OC(C)CC
Molecular Weight1
242.31
Sources

Physical Properties

Property Value Unit Source
Δf -331.48 kJ/mol Joback Calculated Property
Δfgas -689.31 kJ/mol Joback Calculated Property
Δfus 31.68 kJ/mol Joback Calculated Property
Δvap 62.41 kJ/mol Joback Calculated Property
logPoct/wat 2.62 Crippen Calculated Property
Pc 1867.55 kPa Joback Calculated Property
Tboil 653.14 K Joback Calculated Property
Tc 838.21 K Joback Calculated Property
Tfus 360.51 K Joback Calculated Property
Vc 0.79 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 547.34 J/mol×K 653.14 Joback Calculated Property
η 0.00 Pa×s 653.14 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
>C=O (nonring) 2
-CH2- 5
=CH- 2
-CH3 3

Similar Compounds

Fumaric acid, 2-butyl hexyl ester. Fumaric acid, 2-butyl heptyl ester. Fumaric acid, butyl 2-butyl ester. Fumaric acid, 2-butyl octyl ester. Fumaric acid, 2-butyl isohexyl ester. Fumaric acid, 2-butyl hexadecyl ester. Fumaric acid, 2-butyl tridecyl ester. Fumaric acid, 2-butyl pentadecyl ester. Fumaric acid, 2-butyl undecyl ester. Fumaric acid, 2-butyl dodecyl ester. Fumaric acid, 2-butyl nonyl ester. Fumaric acid, 2-butyl tetradecyl ester. Fumaric acid, 2-butyl octadecyl ester. Fumaric acid, 2-butyl decyl ester. Fumaric acid, 2-butyl eicosyl ester.

Find more compounds similar to Fumaric acid, 2-butyl pentyl ester.

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