Chemical Properties of Adipic acid, isohexyl pent-4-enyl ester

Adipic acid, isohexyl pent-4-enyl ester

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InChI
InChI=1S/C17H30O4/c1-4-5-8-13-20-16(18)11-6-7-12-17(19)21-14-9-10-15(2)3/h4,15H,1,5-14H2,2-3H3
InChI Key
DQGXHUOVOKREPW-UHFFFAOYSA-N
Formula
C17H30O4
SMILES
C=CCCCOC(=O)CCCCC(=O)OCCCC(C)C
Molecular Weight1
298.42
Sources

Physical Properties

Property Value Unit Source
Δf -290.18 kJ/mol Joback Calculated Property
Δfgas -763.66 kJ/mol Joback Calculated Property
Δfus 40.56 kJ/mol Joback Calculated Property
Δvap 70.69 kJ/mol Joback Calculated Property
logPoct/wat 4.04 Crippen Calculated Property
Pc 1363.65 kPa Joback Calculated Property
Tboil 737.18 K Joback Calculated Property
Tc 917.39 K Joback Calculated Property
Tfus 408.91 K Joback Calculated Property
Vc 1.01 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 766.33 J/mol×K 737.18 Joback Calculated Property
η 0.00 Pa×s 737.18 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
>C=O (nonring) 2
=CH2 1
-CH2- 10
=CH- 1
-CH3 2

Similar Compounds

Adipic acid, hexyl pent-4-enyl ester. Sebacic acid, isohexyl pent-4-enyl ester. Adipic acid, ethyl pent-4-enyl ester. Adipic acid, di(pent-4-enyl) ester. Adipic acid, butyl pent-4-enyl ester. Adipic acid, pent-4-enyl propyl ester. Adipic acid, heptyl pent-4-enyl ester. Adipic acid, pentadecyl pent-4-enyl ester. Adipic acid, decyl pent-4-enyl ester. Adipic acid, octyl pent-4-enyl ester. Adipic acid, eicosyl pent-4-enyl ester. Adipic acid, nonyl pent-4-enyl ester. Adipic acid, octadecyl pent-4-enyl ester. Adipic acid, pent-4-enyl tetradecyl ester. Adipic acid, pent-4-enyl undecyl ester.

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