Chemical Properties of Sebacic acid, 4-chloro-2-methylphenyl hexyl ester

Sebacic acid, 4-chloro-2-methylphenyl hexyl ester

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InChI
InChI=1S/C23H35ClO4/c1-3-4-5-12-17-27-22(25)13-10-8-6-7-9-11-14-23(26)28-21-16-15-20(24)18-19(21)2/h15-16,18H,3-14,17H2,1-2H3
InChI Key
JJKZLGOTGBZXJR-UHFFFAOYSA-N
Formula
C23H35ClO4
SMILES
CCCCCCOC(=O)CCCCCCCCC(=O)Oc1ccc(Cl)cc1C
Molecular Weight1
410.98
Sources

Physical Properties

Property Value Unit Source
Δf -243.84 kJ/mol Joback Calculated Property
Δfgas -809.80 kJ/mol Joback Calculated Property
Δfus 58.36 kJ/mol Joback Calculated Property
Δvap 93.09 kJ/mol Joback Calculated Property
logPoct/wat 6.80 Crippen Calculated Property
Pc 1061.02 kPa Joback Calculated Property
Tboil 952.29 K Joback Calculated Property
Tc 1166.50 K Joback Calculated Property
Tfus 574.67 K Joback Calculated Property
Vc 1.31 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1084.19 J/mol×K 952.29 Joback Calculated Property
η 0.00 Pa×s 952.29 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-Cl 1
=CH- (ring) 3
=C< (ring) 3
-CH2- 13
-CH3 2
>C=O (nonring) 2

Similar Compounds

Sebacic acid, 4-chloro-2-methylphenyl undecyl ester. Sebacic acid, 4-chloro-2-methylphenyl octyl ester. Sebacic acid, 4-chloro-2-methylphenyl nonyl ester. Sebacic acid, 4-chloro-2-methylphenyl heptyl ester. Sebacic acid, 4-chloro-2-methylphenyl pentyl ester. Sebacic acid, 4-chloro-2-methylphenyl decyl ester. Sebacic acid, butyl 4-chloro-2-methylphenyl ester. Sebacic acid, 4-chloro-2-methylphenyl isohexyl ester. Sebacic acid, 4-chloro-2-methylphenyl isobutyl ester. Glutaric acid, 2-methyl-4-chlorophenyl tetradecyl ester. Glutaric acid, 2-methyl-4-chlorophenyl octyl ester. Glutaric acid, 2-methyl-4-chlorophenyl undecyl ester. Glutaric acid, dodecyl 2-methyl-4-chlorophenyl ester. Glutaric acid, hexadecyl 2-methyl-4-chlorophenyl ester. Glutaric acid, heptyl 2-methyl-4-chlorophenyl ester.

Find more compounds similar to Sebacic acid, 4-chloro-2-methylphenyl hexyl ester.

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