Chemical Properties of Sebacic acid, 4-acetylphenyl isobutyl ester

Sebacic acid, 4-acetylphenyl isobutyl ester

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InChI
InChI=1S/C22H32O5/c1-17(2)16-26-21(24)10-8-6-4-5-7-9-11-22(25)27-20-14-12-19(13-15-20)18(3)23/h12-15,17H,4-11,16H2,1-3H3
InChI Key
SAIWYTGOQZOUGZ-UHFFFAOYSA-N
Formula
C22H32O5
SMILES
CC(=O)c1ccc(OC(=O)CCCCCCCCC(=O)OCC(C)C)cc1
Molecular Weight1
376.49
Sources

Physical Properties

Property Value Unit Source
Δf -362.06 kJ/mol Joback Calculated Property
Δfgas -879.81 kJ/mol Joback Calculated Property
Δfus 50.04 kJ/mol Joback Calculated Property
Δvap 92.17 kJ/mol Joback Calculated Property
logPoct/wat 5.11 Crippen Calculated Property
Pc 1230.28 kPa Joback Calculated Property
Tboil 940.43 K Joback Calculated Property
Tc 1154.17 K Joback Calculated Property
Tfus 555.89 K Joback Calculated Property
Vc 1.21 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1013.54 J/mol×K 940.43 Joback Calculated Property
η 0.00 Pa×s 940.43 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Sebacic acid, 4-acetylphenyl propyl ester. Sebacic acid, 4-acetylphenyl butyl ester. Sebacic acid, 4-acetylphenyl octyl ester. Sebacic acid, 4-acetylphenyl nonyl ester. Sebacic acid, 4-acetylphenyl hexyl ester. Sebacic acid, 4-acetylphenyl pentyl ester. Sebacic acid, 4-acetylphenyl heptyl ester. Sebacic acid, 4-acetylphenyl ethyl ester. Sebacic acid, 4-acetylphenyl isohexyl ester. Glutaric acid, 4-acetylphenyl isobutyl ester. Glutaric acid, 4-acetylphenyl decyl ester. Glutaric acid, 4-acetylphenyl octyl ester. Glutaric acid, 4-acetylphenyl tetradecyl ester. Glutaric acid, 4-acetylphenyl undecyl ester. Glutaric acid, 4-acetylphenyl nonyl ester.

Find more compounds similar to Sebacic acid, 4-acetylphenyl isobutyl ester.

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