Chemical Properties of Sebacic acid, isobutyl tetradecyl ester

Sebacic acid, isobutyl tetradecyl ester

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InChI
InChI=1S/C28H54O4/c1-4-5-6-7-8-9-10-11-12-15-18-21-24-31-27(29)22-19-16-13-14-17-20-23-28(30)32-25-26(2)3/h26H,4-25H2,1-3H3
InChI Key
OVCSJWFGTRHLEA-UHFFFAOYSA-N
Formula
C28H54O4
SMILES
CCCCCCCCCCCCCCOC(=O)CCCCCCCCC(=O)OCC(C)C
Molecular Weight1
454.73
Sources

Physical Properties

Property Value Unit Source
Δf -285.40 kJ/mol Joback Calculated Property
Δfgas -1116.13 kJ/mol Joback Calculated Property
Δfus 70.33 kJ/mol Joback Calculated Property
Δvap 95.85 kJ/mol Joback Calculated Property
logPoct/wat 8.55 Crippen Calculated Property
Pc 690.34 kPa Joback Calculated Property
Tboil 992.18 K Joback Calculated Property
Tc 1230.25 K Joback Calculated Property
Tfus 534.64 K Joback Calculated Property
Vc 1.65 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1474.86 J/mol×K 992.18 Joback Calculated Property
η 0.00 Pa×s 992.18 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
-CH2- 22
>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, 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. Sebacic acid, hexyl isobutyl ester. Pimelic acid, 2-methylpropyl undecyl ester.

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