Chemical Properties of Sebacic acid, dodecyl isohexyl ester

Sebacic acid, dodecyl isohexyl ester

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InChI
InChI=1S/C28H54O4/c1-4-5-6-7-8-9-10-13-16-19-24-31-27(29)22-17-14-11-12-15-18-23-28(30)32-25-20-21-26(2)3/h26H,4-25H2,1-3H3
InChI Key
QLEYDJPUWADWOY-UHFFFAOYSA-N
Formula
C28H54O4
SMILES
CCCCCCCCCCCCOC(=O)CCCCCCCCC(=O)OCCCC(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, isohexyl propyl ester. Sebacic acid, nonyl isohexyl ester. Sebacic acid, decyl isohexyl ester. Sebacic acid, ethyl isohexyl ester. Sebacic acid, butyl isohexyl ester. Sebacic acid, hexyl isohexyl ester. Sebacic acid, heptyl isohexyl ester. Sebacic acid, diisohexyl ester. Sebacic acid, isohexyl tetradecyl ester. Sebacic acid, isohexyl undecyl ester. Sebacic acid, isohexyl octyl ester. Nonanoic acid, isohexyl ester. Sebacic acid, isohexyl pentadecyl ester. Sebacic acid, isohexyl pentyl ester. 4-Methylpentyl 8-methylnonanoate.

Find more compounds similar to Sebacic acid, dodecyl isohexyl ester.

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