Chemical Properties of Sebacic acid, hexadecyl 3-methylbut-2-yl ester

Sebacic acid, hexadecyl 3-methylbut-2-yl ester

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InChI
InChI=1S/C31H60O4/c1-5-6-7-8-9-10-11-12-13-14-15-18-21-24-27-34-30(32)25-22-19-16-17-20-23-26-31(33)35-29(4)28(2)3/h28-29H,5-27H2,1-4H3
InChI Key
SAGAOSXQBUSHOT-UHFFFAOYSA-N
Formula
C31H60O4
SMILES
CCCCCCCCCCCCCCCCOC(=O)CCCCCCCCC(=O)OC(C)C(C)C
Molecular Weight1
496.81
Sources

Physical Properties

Property Value Unit Source
Δf -262.58 kJ/mol Joback Calculated Property
Δfgas -1183.33 kJ/mol Joback Calculated Property
Δfus 74.57 kJ/mol Joback Calculated Property
Δvap 102.14 kJ/mol Joback Calculated Property
logPoct/wat 9.72 Crippen Calculated Property
Pc 598.97 kPa Joback Calculated Property
Tboil 1060.38 K Joback Calculated Property
Tc 1335.48 K Joback Calculated Property
Tfus 553.45 K Joback Calculated Property
Vc 1.81 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1671.19 J/mol×K 1060.38 Joback Calculated Property
η 0.00 Pa×s 1060.38 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 2
-O- (nonring) 2
-CH2- 23
>C=O (nonring) 2
-CH3 4

Similar Compounds

Sebacic acid, 3-methylbut-2-yl octyl ester. Sebacic acid, 3-methylbut-2-yl tetradecyl ester. Sebacic acid, 3-methylbut-2-yl undecyl ester. Sebacic acid, 3-methylbut-2-yl nonyl ester. Sebacic acid, dodecyl 3-methylbut-2-yl ester. Sebacic acid, 3-methylbut-2-yl pentyl ester. Sebacic acid, 3-methylbut-2-yl pentadecyl ester. Sebacic acid, decyl 3-methylbut-2-yl ester. Sebacic acid, heptadecyl 3-methylbut-2-yl ester. Sebacic acid, heptyl 3-methylbut-2-yl ester. Sebacic acid, 3-methylbut-2-yl tridecyl ester. Sebacic acid, hexyl 3-methylbut-2-yl ester. Sebacic acid, isohexyl 3-methylbut-2-yl ester. Sebacic acid, isobutyl 3-methylbut-2-yl ester. Sebacic acid, ethyl 3-methylbut-2-yl ester.

Find more compounds similar to Sebacic acid, hexadecyl 3-methylbut-2-yl ester.

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