Chemical Properties of Diethylmalonic acid, octyl 3-phenoxybenzyl ester

Diethylmalonic acid, octyl 3-phenoxybenzyl ester

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InChI
InChI=1S/C28H38O5/c1-4-7-8-9-10-14-20-31-26(29)28(5-2,6-3)27(30)32-22-23-16-15-19-25(21-23)33-24-17-12-11-13-18-24/h11-13,15-19,21H,4-10,14,20,22H2,1-3H3
InChI Key
NISSBEZXEKFNNE-UHFFFAOYSA-N
Formula
C28H38O5
SMILES
CCCCCCCCOC(=O)C(CC)(CC)C(=O)OCc1cccc(Oc2ccccc2)c1
Molecular Weight1
454.60
Sources

Physical Properties

Property Value Unit Source
Δf -169.93 kJ/mol Joback Calculated Property
Δfgas -790.23 kJ/mol Joback Calculated Property
Δfus 55.32 kJ/mol Joback Calculated Property
Δvap 102.56 kJ/mol Joback Calculated Property
logPoct/wat 7.23 Crippen Calculated Property
Pc 998.28 kPa Joback Calculated Property
Tboil 1070.15 K Joback Calculated Property
Tc 1310.17 K Joback Calculated Property
Tfus 639.65 K Joback Calculated Property
Vc 1.44 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1287.36 J/mol×K 1070.15 Joback Calculated Property
η 0.00 Pa×s 1070.15 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 3
>C=O (nonring) 2
=CH- (ring) 9
=C< (ring) 3
-CH2- 10
>C< 1
-CH3 3

Similar Compounds

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

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

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