Chemical Properties of Adipic acid, 3-hexyl tridecyl ester

Adipic acid, 3-hexyl tridecyl ester

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InChI
InChI=1S/C25H48O4/c1-4-7-8-9-10-11-12-13-14-15-18-22-28-24(26)20-16-17-21-25(27)29-23(6-3)19-5-2/h23H,4-22H2,1-3H3
InChI Key
LUKLQDYNAPLRMP-UHFFFAOYSA-N
Formula
C25H48O4
SMILES
CCCCCCCCCCCCCOC(=O)CCCCC(=O)OC(CC)CCC
Molecular Weight1
412.65
Sources

Physical Properties

Property Value Unit Source
Δf -310.66 kJ/mol Joback Calculated Property
Δfgas -1054.21 kJ/mol Joback Calculated Property
Δfus 62.56 kJ/mol Joback Calculated Property
Δvap 89.17 kJ/mol Joback Calculated Property
logPoct/wat 7.52 Crippen Calculated Property
Pc 807.99 kPa Joback Calculated Property
Tboil 923.54 K Joback Calculated Property
Tc 1133.47 K Joback Calculated Property
Tfus 500.83 K Joback Calculated Property
Vc 1.48 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1281.56 J/mol×K 923.54 Joback Calculated Property
η 0.00 Pa×s 923.54 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
-CH2- 19
>C=O (nonring) 2
-CH3 3

Similar Compounds

Adipic acid, 3-hexyl octyl ester. Adipic acid, 3-hexyl tetradecyl ester. Adipic acid, hexadecyl 3-hexyl ester. Adipic acid, heptadecyl 3-hexyl ester. Adipic acid, dodecyl 3-hexyl ester. Adipic acid, 3-hexyl pentadecyl ester. Adipic acid, 3-hexyl undecyl ester. Adipic acid, eicosyl 3-hexyl ester. Adipic acid, decyl 3-hexyl ester. Adipic acid, 3-hexyl nonyl ester. Adipic acid, 3-hexyl octadecyl ester. Adipic acid, heptyl 3-hexyl ester. Adipic acid, 4-heptyl tetradecyl ester. Adipic acid, 4-heptyl octyl ester. Adipic acid, dodecyl 4-heptyl ester.

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