Chemical Properties of Diethylmalonic acid, di(hept-4-yl) ester

Diethylmalonic acid, di(hept-4-yl) ester

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InChI
InChI=1S/C21H40O4/c1-7-13-17(14-8-2)24-19(22)21(11-5,12-6)20(23)25-18(15-9-3)16-10-4/h17-18H,7-16H2,1-6H3
InChI Key
UCVAAUPRJHJSSC-UHFFFAOYSA-N
Formula
C21H40O4
SMILES
CCCC(CCC)OC(=O)C(CC)(CC)C(=O)OC(CCC)CCC
Molecular Weight1
356.54
Sources

Physical Properties

Property Value Unit Source
Δf -343.94 kJ/mol Joback Calculated Property
Δfgas -985.68 kJ/mol Joback Calculated Property
Δfus 41.26 kJ/mol Joback Calculated Property
Δvap 78.58 kJ/mol Joback Calculated Property
logPoct/wat 5.82 Crippen Calculated Property
Pc 1035.90 kPa Joback Calculated Property
Tboil 828.35 K Joback Calculated Property
Tc 1018.59 K Joback Calculated Property
Tfus 443.17 K Joback Calculated Property
Vc 1.24 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1031.95 J/mol×K 828.35 Joback Calculated Property
η 0.00 Pa×s 828.35 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 2
-O- (nonring) 2
>C=O (nonring) 2
-CH2- 10
>C< 1
-CH3 6

Similar Compounds

Diethylmalonic acid, ethyl hept-4-yl ester. Diethylmalonic acid, hept-4-yl propyl ester. Diethylmalonic acid, butyl hept-4-yl ester. Diethylmalonic acid, hept-4-yl isobutyl ester. Diethylmalonic acid, hept-4-yl pentyl ester. Diethylmalonic acid, hept-4-yl hexyl ester. Diethylmalonic acid, hept-4-yl undecyl ester. Diethylmalonic acid, dodecyl hept-4-yl ester. Diethylmalonic acid, hept-4-yl tetradecyl ester. Diethylmalonic acid, hept-4-yl pentadecyl ester. Diethylmalonic acid, hept-4-yl hexadecyl ester. Diethylmalonic acid, heptadecyl hept-4-yl ester. Diethylmalonic acid, heptyl hept-4-yl ester. Diethylmalonic acid, decyl hept-4-yl ester. Diethylmalonic acid, hept-4-yl tridecyl ester.

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