Chemical Properties of Sebacic acid, hexyl isobutyl ester

Sebacic acid, hexyl isobutyl ester

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InChI
InChI=1S/C20H38O4/c1-4-5-6-13-16-23-19(21)14-11-9-7-8-10-12-15-20(22)24-17-18(2)3/h18H,4-17H2,1-3H3
InChI Key
ZJUWHSHSDMQPMC-UHFFFAOYSA-N
Formula
C20H38O4
SMILES
CCCCCCOC(=O)CCCCCCCCC(=O)OCC(C)C
Molecular Weight1
342.51
Sources

Physical Properties

Property Value Unit Source
Δf -352.76 kJ/mol Joback Calculated Property
Δfgas -951.01 kJ/mol Joback Calculated Property
Δfus 49.61 kJ/mol Joback Calculated Property
Δvap 78.04 kJ/mol Joback Calculated Property
logPoct/wat 5.43 Crippen Calculated Property
Pc 1083.49 kPa Joback Calculated Property
Tboil 809.14 K Joback Calculated Property
Tc 993.61 K Joback Calculated Property
Tfus 444.48 K Joback Calculated Property
Vc 1.20 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 969.66 J/mol×K 809.14 Joback Calculated Property
η 0.00 Pa×s 809.14 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
-CH2- 14
>C=O (nonring) 2
-CH3 3

Similar Compounds

Sebacic acid, isobutyl octyl ester. Pimelic acid, 2-methylpropyl nonyl ester. Pimelic acid, 2-methylpropyl pentadecyl ester. Pimelic acid, 2-methylpropyl octadecyl ester. Pimelic acid, 2-methylpropyl octyl ester. Sebacic acid, isobutyl nonyl ester. Sebacic acid, isobutyl pentyl ester. Sebacic acid, isobutyl tetradecyl ester. Sebacic acid, decyl isobutyl ester. Pimelic acid, decyl 2-methylpropyl ester. Pimelic acid, hexadecyl 2-methylpropyl ester. Sebacic acid, heptadecyl isobutyl ester. Pimelic acid, 2-methylpropyl tridecyl ester. Pimelic acid, 2-methylpropyl tetradecyl ester. Pimelic acid, 2-methylpropyl undecyl ester.

Find more compounds similar to Sebacic acid, hexyl isobutyl ester.

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