Chemical Properties of Sebacic acid, hexyl undecyl ester

Sebacic acid, hexyl undecyl ester

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InChI
InChI=1S/C27H52O4/c1-3-5-7-9-10-11-14-17-21-25-31-27(29)23-19-16-13-12-15-18-22-26(28)30-24-20-8-6-4-2/h3-25H2,1-2H3
InChI Key
SPXDSDRGXICRHF-UHFFFAOYSA-N
Formula
C27H52O4
SMILES
CCCCCCCCCCCOC(=O)CCCCCCCCC(=O)OCCCCCC
Molecular Weight1
440.70
Sources

Physical Properties

Property Value Unit Source
Δf -291.38 kJ/mol Joback Calculated Property
Δfgas -1090.21 kJ/mol Joback Calculated Property
Δfus 71.26 kJ/mol Joback Calculated Property
Δvap 94.01 kJ/mol Joback Calculated Property
logPoct/wat 8.30 Crippen Calculated Property
Pc 723.40 kPa Joback Calculated Property
Tboil 969.74 K Joback Calculated Property
Tc 1199.13 K Joback Calculated Property
Tfus 538.37 K Joback Calculated Property
Vc 1.60 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1409.71 J/mol×K 969.74 Joback Calculated Property
η 0.00 Pa×s 969.74 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Sebacic acid, diheptyl ester. Sebacic acid, decyl propyl ester. Sebacic acid, ethyl tetradecyl ester. Hexyl laurate. Sebacic acid, heptyl pentyl ester. Sebacic acid, butyl pentadecyl ester. Hexadecanoic acid, dodecyl ester. Sebacic acid, heptyl hexyl ester. Diamyl azelate. Sebacic acid, dinonyl ester. Sebacic acid, propyl undecyl ester. Octyl myristate. Sebacic acid, octyl undecyl ester. Sebacic acid, ethyl octyl ester. Decanedioic acid, dipentyl ester.

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