Chemical Properties of Sebacic acid, di(2-acetylphenyl) ester

Sebacic acid, di(2-acetylphenyl) ester

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InChI
InChI=1S/C26H30O6/c1-19(27)21-13-9-11-15-23(21)31-25(29)17-7-5-3-4-6-8-18-26(30)32-24-16-12-10-14-22(24)20(2)28/h9-16H,3-8,17-18H2,1-2H3
InChI Key
MSKCJRWMWHHQJW-UHFFFAOYSA-N
Formula
C26H30O6
SMILES
CC(=O)c1ccccc1OC(=O)CCCCCCCCC(=O)Oc1ccccc1C(C)=O
Molecular Weight1
438.51
Sources

Physical Properties

Property Value Unit Source
Δf -352.08 kJ/mol Joback Calculated Property
Δfgas -844.61 kJ/mol Joback Calculated Property
Δfus 59.17 kJ/mol Joback Calculated Property
Δvap 111.15 kJ/mol Joback Calculated Property
logPoct/wat 5.72 Crippen Calculated Property
Pc 1219.14 kPa Joback Calculated Property
Tboil 1117.92 K Joback Calculated Property
Tc 1368.69 K Joback Calculated Property
Tfus 704.84 K Joback Calculated Property
Vc 1.34 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1147.34 J/mol×K 1117.92 Joback Calculated Property
η 0.00 Pa×s 1117.92 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
>C=O (nonring) 4
=CH- (ring) 8
=C< (ring) 4
-CH2- 8
-CH3 2

Similar Compounds

Sebacic acid, 2-acetylphenyl ethyl ester. Sebacic acid, 2-acetylphenyl propyl ester. Sebacic acid, 2-acetylphenyl hexyl ester. Sebacic acid, 2-acetylphenyl heptyl ester. Sebacic acid, 2-acetylphenyl pentyl ester. Sebacic acid, 2-acetylphenyl isohexyl ester. 2-Ethylbutyric acid, 2-acethylphenyl ester. Sebacic acid, di(2-ethylphenyl) ester. Adipic acid, di(2-ethylphenyl) ester. Nonanoic acid, 2-propylphenyl ester. Sebacic acid, di(3-propylphenyl) ester. Dodecanoic acid, 2-propylphenyl ester. Glutaric acid, di(2-formylphenyl) ester. Sebacic acid, ethyl 2-ethylphenyl ester. Sebacic acid, di(2-isopropylphenyl) ester.

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