Chemical Properties of Diethylmalonic acid, 3-bromobenzyl octadecyl ester

Diethylmalonic acid, 3-bromobenzyl octadecyl ester

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InChI
InChI=1S/C32H53BrO4/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-36-30(34)32(5-2,6-3)31(35)37-27-28-23-22-24-29(33)26-28/h22-24,26H,4-21,25,27H2,1-3H3
InChI Key
RNGARFMARSIFOE-UHFFFAOYSA-N
Formula
C32H53BrO4
SMILES
CCCCCCCCCCCCCCCCCCOC(=O)C(CC)(CC)C(=O)OCc1cccc(Br)c1
Molecular Weight1
581.66
Sources

Physical Properties

Property Value Unit Source
Δf -129.34 kJ/mol Joback Calculated Property
Δfgas -950.77 kJ/mol Joback Calculated Property
Δfus 75.73 kJ/mol Joback Calculated Property
Δvap 113.22 kJ/mol Joback Calculated Property
logPoct/wat 10.10 Crippen Calculated Property
Pc 694.71 kPa Joback Calculated Property
Tboil 1178.73 K Joback Calculated Property
Tc 1473.01 K Joback Calculated Property
Tfus 695.88 K Joback Calculated Property
Vc 1.82 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1664.17 J/mol×K 1178.73 Joback Calculated Property
η 0.00 Pa×s 1178.73 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
>C=O (nonring) 2
=CH- (ring) 4
=C< (ring) 2
-CH2- 20
>C< 1
-CH3 3
-Br 1

Similar Compounds

Diethylmalonic acid, 3-bromobenzyl hexadecyl ester. Diethylmalonic acid, 3-bromobenzyl heptadecyl ester. Diethylmalonic acid, 3-bromobenzyl heptyl ester. Diethylmalonic acid, 3-bromobenzyl tridecyl ester. Diethylmalonic acid, 3-bromobenzyl dodecyl ester. Diethylmalonic acid, 3-bromobenzyl nonyl ester. Diethylmalonic acid, 3-bromobenzyl octyl ester. Diethylmalonic acid, 3-bromobenzyl tetradecyl ester. Diethylmalonic acid, 3-bromobenzyl decyl ester. Diethylmalonic acid, 3-bromobenzyl hexyl ester. Diethylmalonic acid, 3-bromobenzyl pentyl ester. Diethylmalonic acid, 3-bromobenzyl butyl ester. Diethylmalonic acid, 3-bromobenzyl isobutyl ester. Diethylmalonic acid, 4-bromobenzyl heptyl ester. Diethylmalonic acid, 4-bromobenzyl hexyl ester.

Find more compounds similar to Diethylmalonic acid, 3-bromobenzyl octadecyl ester.

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