Chemical Properties of Diethylmalonic acid, 4-chloro-2-methylphenyl heptyl ester

Diethylmalonic acid, 4-chloro-2-methylphenyl heptyl ester

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InChI
InChI=1S/C21H31ClO4/c1-5-8-9-10-11-14-25-19(23)21(6-2,7-3)20(24)26-18-13-12-17(22)15-16(18)4/h12-13,15H,5-11,14H2,1-4H3
InChI Key
ISNHCDNQLSTHHS-UHFFFAOYSA-N
Formula
C21H31ClO4
SMILES
CCCCCCCOC(=O)C(CC)(CC)C(=O)Oc1ccc(Cl)cc1C
Molecular Weight1
382.92
Sources

Physical Properties

Property Value Unit Source
Δf -257.84 kJ/mol Joback Calculated Property
Δfgas -777.27 kJ/mol Joback Calculated Property
Δfus 45.77 kJ/mol Joback Calculated Property
Δvap 87.34 kJ/mol Joback Calculated Property
logPoct/wat 5.87 Crippen Calculated Property
Pc 1223.41 kPa Joback Calculated Property
Tboil 903.30 K Joback Calculated Property
Tc 1114.76 K Joback Calculated Property
Tfus 554.55 K Joback Calculated Property
Vc 1.19 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 964.07 J/mol×K 903.3 Joback Calculated Property
η 0.00 Pa×s 903.3 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-CH3 4
=CH- (ring) 3
=C< (ring) 3
-CH2- 8
-Cl 1
>C< 1
>C=O (nonring) 2

Similar Compounds

Diethylmalonic acid, 4-chloro-2-methylphenyl hexadecyl ester. Diethylmalonic acid, 4-chloro-2-methylphenyl undecyl ester. Diethylmalonic acid, 4-chloro-2-methylphenyl heptadecyl ester. Diethylmalonic acid, 4-chloro-2-methylphenyl tridecyl ester. Diethylmalonic acid, 4-chloro-2-methylphenyl octyl ester. Diethylmalonic acid, 4-chloro-2-methylphenyl decyl ester. Diethylmalonic acid, 4-chloro-2-methylphenyl tetradecyl ester. Diethylmalonic acid, 4-chloro-2-methylphenyl nonyl ester. Diethylmalonic acid, 4-chloro-2-methylphenyl dodecyl ester. Diethylmalonic acid, 4-chloro-2-methylphenyl hexyl ester. Diethylmalonic acid, 4-chloro-2-methylphenyl pentyl ester. Diethylmalonic acid, butyl 4-chloro-2-methylphenyl ester. Diethylmalonic acid, 4-chloro-2-methylphenyl propyl ester. Diethylmalonic acid, 4-chloro-2-methylphenyl isobutyl ester. Diethylmalonic acid, 4-chloro-2-methylphenyl ethyl ester.

Find more compounds similar to Diethylmalonic acid, 4-chloro-2-methylphenyl heptyl ester.

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