Chemical Properties of Sebacic acid, heptyl isohexyl ester

Sebacic acid, heptyl isohexyl ester

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C23H44O4/c1-4-5-6-11-14-19-26-22(24)17-12-9-7-8-10-13-18-23(25)27-20-15-16-21(2)3/h21H,4-20H2,1-3H3
InChI Key
MBUYCEOISVFTQH-UHFFFAOYSA-N
Formula
C23H44O4
SMILES
CCCCCCCOC(=O)CCCCCCCCC(=O)OCCCC(C)C
Molecular Weight1
384.59
Sources

Physical Properties

Property Value Unit Source
Δf -327.50 kJ/mol Joback Calculated Property
Δfgas -1012.93 kJ/mol Joback Calculated Property
Δfus 57.38 kJ/mol Joback Calculated Property
Δvap 84.72 kJ/mol Joback Calculated Property
logPoct/wat 6.60 Crippen Calculated Property
Pc 903.97 kPa Joback Calculated Property
Tboil 877.78 K Joback Calculated Property
Tc 1074.72 K Joback Calculated Property
Tfus 478.29 K Joback Calculated Property
Vc 1.37 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1154.96 J/mol×K 877.78 Joback Calculated Property
η 0.00 Pa×s 877.78 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
-CH2- 17
-CH3 3
>C=O (nonring) 2

Similar Compounds

Sebacic acid, isohexyl propyl ester. Sebacic acid, nonyl isohexyl ester. Sebacic acid, dodecyl isohexyl ester. Sebacic acid, decyl isohexyl ester. Sebacic acid, ethyl isohexyl ester. Sebacic acid, butyl isohexyl ester. Sebacic acid, hexyl 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, heptyl isohexyl ester.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.