Chemical Properties of Sebacic acid, 3,3-dimethylbut-2-yl heptyl ester

Sebacic acid, 3,3-dimethylbut-2-yl heptyl ester

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InChI
InChI=1S/C23H44O4/c1-6-7-8-13-16-19-26-21(24)17-14-11-9-10-12-15-18-22(25)27-20(2)23(3,4)5/h20H,6-19H2,1-5H3
InChI Key
RCEQHCVMPYSOCU-UHFFFAOYSA-N
Formula
C23H44O4
SMILES
CCCCCCCOC(=O)CCCCCCCCC(=O)OC(C)C(C)(C)C
Molecular Weight1
384.59
Sources

Physical Properties

Property Value Unit Source
Δf -324.66 kJ/mol Joback Calculated Property
Δfgas -1021.68 kJ/mol Joback Calculated Property
Δfus 49.96 kJ/mol Joback Calculated Property
Δvap 83.42 kJ/mol Joback Calculated Property
logPoct/wat 6.60 Crippen Calculated Property
Pc 914.39 kPa Joback Calculated Property
Tboil 874.55 K Joback Calculated Property
Tc 1070.98 K Joback Calculated Property
Tfus 480.71 K Joback Calculated Property
Vc 1.35 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1155.24 J/mol×K 874.55 Joback Calculated Property
η 0.00 Pa×s 874.55 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
-CH3 5
-CH2- 14
>C< 1
>C=O (nonring) 2

Similar Compounds

Sebacic acid, 3,3-dimethylbut-2-yl nonyl ester. Sebacic acid, 3,3-dimethylbut-2-yl hexyl ester. Sebacic acid, 3,3-dimethylbut-2-yl tetradecyl ester. Sebacic acid, 3,3-dimethylbut-2-yl hexadecyl ester. Sebacic acid, 3,3-dimethylbut-2-yl dodecyl ester. Sebacic acid, 3,3-dimethylbut-2-yl pentyl ester. Sebacic acid, 3,3-dimethylbut-2-yl undecyl ester. Sebacic acid, decyl 3,3-dimethylbut-2-yl ester. Sebacic acid, 3,3-dimethylbut-2-yl tridecyl ester. Sebacic acid, 3,3-dimethylbut-2-yl pentadecyl ester. Sebacic acid, 3,3-dimethylbut-2-yl octyl ester. Sebacic acid, butyl 3,3-dimethylbut-2-yl ester. Sebacic acid, 3,3-dimethylbut-2-yl isohexyl ester. Adipic acid, 3,3-dimethylbut-2-yl octadecyl ester. Adipic acid, 3,3-dimethylbut-2-yl tetradecyl ester.

Find more compounds similar to Sebacic acid, 3,3-dimethylbut-2-yl heptyl ester.

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