Chemical Properties of Diethylmalonic acid, 4-chlorobenzyl isobutyl ester

Diethylmalonic acid, 4-chlorobenzyl isobutyl ester

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C18H25ClO4/c1-5-18(6-2,16(20)22-11-13(3)4)17(21)23-12-14-7-9-15(19)10-8-14/h7-10,13H,5-6,11-12H2,1-4H3
InChI Key
WJYIIZVVQAGCKC-UHFFFAOYSA-N
Formula
C18H25ClO4
SMILES
CCC(CC)(C(=O)OCc1ccc(Cl)cc1)C(=O)OCC(C)C
Molecular Weight1
340.84
Sources

Physical Properties

Property Value Unit Source
Δf -275.91 kJ/mol Joback Calculated Property
Δfgas -709.16 kJ/mol Joback Calculated Property
Δfus 34.86 kJ/mol Joback Calculated Property
Δvap 79.61 kJ/mol Joback Calculated Property
logPoct/wat 4.39 Crippen Calculated Property
Pc 1540.29 kPa Joback Calculated Property
Tboil 829.24 K Joback Calculated Property
Tc 1042.39 K Joback Calculated Property
Tfus 493.22 K Joback Calculated Property
Vc 1.02 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 790.24 J/mol×K 829.24 Joback Calculated Property
η 0.00 Pa×s 829.24 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Diethylmalonic acid, 4-chlorobenzyl propyl ester. Diethylmalonic acid, butyl 4-chlorobenzyl ester. Diethylmalonic acid, 4-chlorobenzyl hexyl ester. Diethylmalonic acid, 4-chlorobenzyl heptyl ester. Diethylmalonic acid, 4-chlorobenzyl octyl ester. Diethylmalonic acid, 4-chlorobenzyl tridecyl ester. Diethylmalonic acid, 4-chlorobenzyl dodecyl ester. Diethylmalonic acid, 4-chlorobenzyl undecyl ester. Diethylmalonic acid, 4-chlorobenzyl decyl ester. Diethylmalonic acid, 4-chlorobenzyl tetradecyl ester. Diethylmalonic acid, 4-chlorobenzyl nonyl ester. Diethylmalonic acid, 4-chlorobenzyl ethyl ester. Diethylmalonic acid, 3-chlorobenzyl isobutyl ester. Diethylmalonic acid, 3-chlorobenzyl propyl ester. Diethylmalonic acid, 3-chlorobenzyl pentyl ester.

Find more compounds similar to Diethylmalonic acid, 4-chlorobenzyl isobutyl ester.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.