Chemical Properties of Diethylmalonic acid, pentyl 3-phenoxybenzyl ester

Diethylmalonic acid, pentyl 3-phenoxybenzyl ester

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InChI
InChI=1S/C25H32O5/c1-4-7-11-17-28-23(26)25(5-2,6-3)24(27)29-19-20-13-12-16-22(18-20)30-21-14-9-8-10-15-21/h8-10,12-16,18H,4-7,11,17,19H2,1-3H3
InChI Key
WGQMJCWVCDVGSC-UHFFFAOYSA-N
Formula
C25H32O5
SMILES
CCCCCOC(=O)C(CC)(CC)C(=O)OCc1cccc(Oc2ccccc2)c1
Molecular Weight1
412.52
Sources

Physical Properties

Property Value Unit Source
Δf -195.19 kJ/mol Joback Calculated Property
Δfgas -728.31 kJ/mol Joback Calculated Property
Δfus 47.55 kJ/mol Joback Calculated Property
Δvap 95.88 kJ/mol Joback Calculated Property
logPoct/wat 6.06 Crippen Calculated Property
Pc 1208.15 kPa Joback Calculated Property
Tboil 1001.51 K Joback Calculated Property
Tc 1231.22 K Joback Calculated Property
Tfus 605.84 K Joback Calculated Property
Vc 1.27 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1104.59 J/mol×K 1001.51 Joback Calculated Property
η 0.00 Pa×s 1001.51 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 3
>C=O (nonring) 2
=CH- (ring) 9
=C< (ring) 3
-CH2- 7
>C< 1
-CH3 3

Similar Compounds

Diethylmalonic acid, butyl 3-phenoxybenzyl ester. Diethylmalonic acid, hexyl 3-phenoxybenzyl ester. Diethylmalonic acid, 3-phenoxybenzyl propyl ester. Diethylmalonic acid, heptyl 3-phenoxybenzyl ester. Diethylmalonic acid, octyl 3-phenoxybenzyl ester. Diethylmalonic acid, nonyl 3-phenoxybenzyl ester. Diethylmalonic acid, isobutyl 3-phenoxybenzyl ester. Diethylmalonic acid, ethyl 3-phenoxybenzyl ester. Diethylmalonic acid, 4-bromobenzyl pentyl ester. Diethylmalonic acid, 4-bromobenzyl hexyl ester. Diethylmalonic acid, 4-bromobenzyl butyl ester. Diethylmalonic acid, 4-bromobenzyl heptyl ester. Diethylmalonic acid, butyl 4-chlorobenzyl ester. Diethylmalonic acid, 4-chlorobenzyl propyl ester. Diethylmalonic acid, 4-chlorobenzyl hexyl ester.

Find more compounds similar to Diethylmalonic acid, pentyl 3-phenoxybenzyl ester.

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