Chemical Properties of Adipic acid, dodecyl 3-methylbut-3-enyl ester

Adipic acid, dodecyl 3-methylbut-3-enyl ester

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InChI
InChI=1S/C23H42O4/c1-4-5-6-7-8-9-10-11-12-15-19-26-22(24)16-13-14-17-23(25)27-20-18-21(2)3/h2,4-20H2,1,3H3
InChI Key
YIIJFPFLOQCVIH-UHFFFAOYSA-N
Formula
C23H42O4
SMILES
C=C(C)CCOC(=O)CCCCC(=O)OCCCCCCCCCCCC
Molecular Weight1
382.58
Sources

Physical Properties

Property Value Unit Source
Δf -245.77 kJ/mol Joback Calculated Property
Δfgas -892.01 kJ/mol Joback Calculated Property
Δfus 58.31 kJ/mol Joback Calculated Property
Δvap 84.51 kJ/mol Joback Calculated Property
logPoct/wat 6.52 Crippen Calculated Property
Pc 925.55 kPa Joback Calculated Property
Tboil 874.78 K Joback Calculated Property
Tc 1070.98 K Joback Calculated Property
Tfus 477.57 K Joback Calculated Property
Vc 1.35 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1125.69 J/mol×K 874.78 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
=C< 1
>C=O (nonring) 2
=CH2 1
-CH2- 17
-CH3 2

Similar Compounds

Adipic acid, 3-methylbut-3-enyl nonyl ester. Adipic acid, 3-methylbut-3-enyl octadecyl ester. Adipic acid, decyl 3-methylbut-3-enyl ester. Adipic acid, 3-methylbut-3-enyl tridecyl ester. Adipic acid, hexadecyl 3-methylbut-3-enyl ester. Adipic acid, 3-methylbut-3-enyl undecyl ester. Adipic acid, 3-methylbut-3-enyl tetradecyl ester. Adipic acid, 3-methylbut-3-enyl pentadecyl ester. Adipic acid, 3-methylbut-3-enyl octyl ester. Adipic acid, heptadecyl 3-methylbut-3-enyl ester. Adipic acid, heptyl 3-methylbut-3-enyl ester. Adipic acid, hexyl 3-methylbut-3-enyl ester. Adipic acid, 3-methylbut-3-enyl pentyl ester. Sebacic acid, 3-methylbut-3-enyl tetradecyl ester. Sebacic acid, 3-methylbut-3-enyl nonyl ester.

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