Chemical Properties of Diethylmalonic acid, 4-chloro-3-methylphenyl isobutyl ester

Diethylmalonic acid, 4-chloro-3-methylphenyl isobutyl ester

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InChI
InChI=1S/C18H25ClO4/c1-6-18(7-2,16(20)22-11-12(3)4)17(21)23-14-8-9-15(19)13(5)10-14/h8-10,12H,6-7,11H2,1-5H3
InChI Key
LBMGDNJWJDLEEJ-UHFFFAOYSA-N
Formula
C18H25ClO4
SMILES
CCC(CC)(C(=O)OCC(C)C)C(=O)Oc1ccc(Cl)c(C)c1
Molecular Weight1
340.84
Sources

Physical Properties

Property Value Unit Source
Δf -285.54 kJ/mol Joback Calculated Property
Δfgas -720.63 kJ/mol Joback Calculated Property
Δfus 34.47 kJ/mol Joback Calculated Property
Δvap 80.27 kJ/mol Joback Calculated Property
logPoct/wat 4.56 Crippen Calculated Property
Pc 1522.31 kPa Joback Calculated Property
Tboil 834.22 K Joback Calculated Property
Tc 1048.15 K Joback Calculated Property
Tfus 505.74 K Joback Calculated Property
Vc 1.02 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 789.28 J/mol×K 834.22 Joback Calculated Property
η 0.00 Pa×s 834.22 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
-Cl 1
=CH- (ring) 3
=C< (ring) 3
-CH2- 3
>C< 1
-CH3 5
>C=O (nonring) 2

Similar Compounds

Diethylmalonic acid, 4-chloro-3-methylphenyl propyl ester. Diethylmalonic acid, butyl 4-chloro-3-methylphenyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl pentyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl hexyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl nonyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl tetradecyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl decyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl heptadecyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl heptyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl undecyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl tridecyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl octyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl dodecyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl hexadecyl ester. Diethylmalonic acid, 4-chloro-3-methylphenyl ethyl ester.

Find more compounds similar to Diethylmalonic acid, 4-chloro-3-methylphenyl isobutyl ester.

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