Chemical Properties of Sebacic acid, 2,5-dimethylphenyl isobutyl ester

Sebacic acid, 2,5-dimethylphenyl isobutyl ester

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

InChI
InChI=1S/C22H34O4/c1-17(2)16-25-21(23)11-9-7-5-6-8-10-12-22(24)26-20-15-18(3)13-14-19(20)4/h13-15,17H,5-12,16H2,1-4H3
InChI Key
RDEUKMCFXNHEOY-UHFFFAOYSA-N
Formula
C22H34O4
SMILES
Cc1ccc(C)c(OC(=O)CCCCCCCCC(=O)OCC(C)C)c1
Molecular Weight1
362.50
Sources

Physical Properties

Property Value Unit Source
Δf -242.77 kJ/mol Joback Calculated Property
Δfgas -778.70 kJ/mol Joback Calculated Property
Δfus 48.05 kJ/mol Joback Calculated Property
Δvap 86.09 kJ/mol Joback Calculated Property
logPoct/wat 5.529 Crippen Calculated Property
Pc 1165.63 kPa Joback Calculated Property
Tboil 891.54 K Joback Calculated Property
Tc 1096.74 K Joback Calculated Property
Tfus 518.48 K Joback Calculated Property
Vc 1.202 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 997.20 J/mol×K 891.54 Joback Calculated Property
η 0.0000383 Pa×s 891.54 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
>C=O (nonring) 2
=CH- (ring) 3
=C< (ring) 3
-CH2- 9
-CH3 4

Similar Compounds

Sebacic acid, 2,5-dimethylphenyl octyl ester. Sebacic acid, 2,5-dimethylphenyl dodecyl ester. Sebacic acid, 2,5-dimethylphenyl decyl ester. Sebacic acid, 2,5-dimethylphenyl undecyl ester. Sebacic acid, 2,5-dimethylphenyl ethyl ester. Sebacic acid, 2,5-dimethylphenyl isohexyl ester. Glutaric acid, 2,5-dimethylphenyl isobutyl ester. Glutaric acid, 2,5-dimethylphenyl heptyl ester. Glutaric acid, decyl 2,5-dimethylphenyl ester. Glutaric acid, 2,5-dimethylphenyl dodecyl ester. Glutaric acid, 2,5-dimethylphenyl octyl ester. Glutaric acid, 2,5-dimethylphenyl undecyl ester. Glutaric acid, 2,5-dimethylphenyl hexyl ester. Glutaric acid, 2,5-dimethylphenyl propyl ester. Glutaric acid, butyl 2,5-dimethylphenyl ester.

Find more compounds similar to Sebacic acid, 2,5-dimethylphenyl isobutyl 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.