Chemical Properties of Sebacic acid, isohexyl 4-phenylphenyl ester

Sebacic acid, isohexyl 4-phenylphenyl ester

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InChI
InChI=1S/C28H38O4/c1-23(2)13-12-22-31-27(29)16-10-5-3-4-6-11-17-28(30)32-26-20-18-25(19-21-26)24-14-8-7-9-15-24/h7-9,14-15,18-21,23H,3-6,10-13,16-17,22H2,1-2H3
InChI Key
VRVRFIJXMDXAAT-UHFFFAOYSA-N
Formula
C28H38O4
SMILES
CC(C)CCCOC(=O)CCCCCCCCC(=O)Oc1ccc(-c2ccccc2)cc1
Molecular Weight1
438.60
Sources

Physical Properties

Property Value Unit Source
Δf -70.21 kJ/mol Joback Calculated Property
Δfgas -654.54 kJ/mol Joback Calculated Property
Δfus 58.02 kJ/mol Joback Calculated Property
Δvap 101.06 kJ/mol Joback Calculated Property
logPoct/wat 7.36 Crippen Calculated Property
Pc 1002.08 kPa Joback Calculated Property
Tboil 1050.52 K Joback Calculated Property
Tc 1286.15 K Joback Calculated Property
Tfus 600.00 K Joback Calculated Property
Vc 1.43 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1260.78 J/mol×K 1050.52 Joback Calculated Property
η 0.00 Pa×s 1050.52 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
>C=O (nonring) 2
=CH- (ring) 9
=C< (ring) 3
-CH2- 11
-CH3 2

Similar Compounds

Adipic acid, 4-biphenyl isohexyl ester. Sebacic acid, pentyl 4-phenylphenyl ester. Sebacic acid, butyl 4-phenylphenyl ester. Sebacic acid, 4-phenylphenyl propyl ester. Adipic acid, 4-biphenyl octyl ester. Adipic acid, 4-biphenyl heptyl ester. Adipic acid, 4-biphenyl decyl ester. Adipic acid, 4-biphenyl nonyl ester. Sebacic acid, ethyl 4-phenylphenyl ester. Adipic acid, 4-biphenyl pentyl ester. Adipic acid, 4-biphenyl hexyl ester. Adipic acid, 4-biphenyl butyl ester. Sebacic acid, isobutyl 4-phenylphenyl ester. Adipic acid, 4-biphenyl propyl ester. Adipic acid, 4-biphenyl ethyl ester.

Find more compounds similar to Sebacic acid, isohexyl 4-phenylphenyl ester.

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