Chemical Properties of Sebacic acid, 2-hexyl isobutyl ester

Sebacic acid, 2-hexyl isobutyl ester

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InChI
InChI=1S/C20H38O4/c1-5-6-13-18(4)24-20(22)15-12-10-8-7-9-11-14-19(21)23-16-17(2)3/h17-18H,5-16H2,1-4H3
InChI Key
VRGJKTOIAGZFQG-UHFFFAOYSA-N
Formula
C20H38O4
SMILES
CCCCC(C)OC(=O)CCCCCCCCC(=O)OCC(C)C
Molecular Weight1
342.51
Sources

Physical Properties

Property Value Unit Source
Δf -355.20 kJ/mol Joback Calculated Property
Δfgas -956.29 kJ/mol Joback Calculated Property
Δfus 46.08 kJ/mol Joback Calculated Property
Δvap 77.65 kJ/mol Joback Calculated Property
logPoct/wat 5.43 Crippen Calculated Property
Pc 1089.22 kPa Joback Calculated Property
Tboil 808.70 K Joback Calculated Property
Tc 994.02 K Joback Calculated Property
Tfus 429.48 K Joback Calculated Property
Vc 1.19 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 970.14 J/mol×K 808.7 Joback Calculated Property
η 0.00 Pa×s 808.7 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 2
-O- (nonring) 2
-CH2- 12
>C=O (nonring) 2
-CH3 4

Similar Compounds

Sebacic acid, isobutyl 2-octyl ester. Sebacic acid, 2-decyl isobutyl ester. Sebacic acid, 2-heptyl isobutyl ester. Pimelic acid, isobutyl 2-pentyl ester. Adipic acid, 2-decyl isobutyl ester. Sebacic acid, isobutyl 6-methylhept-2-yl ester. Sebacic acid, 2-hexyl tetradecyl ester. Sebacic acid, 2-hexyl propyl ester. Sebacic acid, di(2-hexyl) ester. Sebacic acid, decyl 2-hexyl ester. 2-Hexyl heptadecanoate. Sebacic acid, 2-hexyl nonyl ester. Sebacic acid, 2-hexyl tridecyl ester. Sebacic acid, 2-hexyl octyl ester. Sebacic acid, heptyl 2-hexyl ester.

Find more compounds similar to Sebacic acid, 2-hexyl isobutyl ester.

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