Chemical Properties of Glutaric acid, 3-methyl-4-nitrobenzyl octyl ester

Glutaric acid, 3-methyl-4-nitrobenzyl octyl ester

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InChI
InChI=1S/C21H31NO6/c1-3-4-5-6-7-8-14-27-20(23)10-9-11-21(24)28-16-18-12-13-19(22(25)26)17(2)15-18/h12-13,15H,3-11,14,16H2,1-2H3
InChI Key
NMUYSJUNIWWAQE-UHFFFAOYSA-N
Formula
C21H31NO6
SMILES
CCCCCCCCOC(=O)CCCC(=O)OCc1ccc([N+](=O)[O-])c(C)c1
Molecular Weight1
393.47
Sources

Physical Properties

Property Value Unit Source
Δf -213.20 kJ/mol Joback Calculated Property
Δfgas -763.54 kJ/mol Joback Calculated Property
Δfus 60.34 kJ/mol Joback Calculated Property
Δvap 100.84 kJ/mol Joback Calculated Property
logPoct/wat 5.02 Crippen Calculated Property
Pc 1249.49 kPa Joback Calculated Property
Tboil 1020.94 K Joback Calculated Property
Tc 1250.92 K Joback Calculated Property
Tfus 665.82 K Joback Calculated Property
Vc 1.23 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1046.88 J/mol×K 1020.94 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-CH3 2
=CH- (ring) 3
-NO2 1
=C< (ring) 3
-CH2- 11
>C=O (nonring) 2

Similar Compounds

Glutaric acid, decyl 3-methyl-4-nitrobenzyl ester. Glutaric acid, dodecyl 3-methyl-4-nitrobenzyl ester. Glutaric acid, 3-methyl-4-nitrobenzyl undecyl ester. Glutaric acid, 3-methyl-4-nitrobenzyl nonyl ester. Glutaric acid, 3-methyl-4-nitrobenzyl heptyl ester. Glutaric acid, hexyl 3-methyl-4-nitrobenzyl ester. Glutaric acid, 3-methyl-4-nitrobenzyl pentyl ester. Glutaric acid, butyl 3-methyl-4-nitrobenzyl ester. Glutaric acid, 3-methyl-4-nitrobenzyl propyl ester. Glutaric acid, ethyl 3-methyl-4-nitrobenzyl ester. Sebacic acid, butyl 3-methyl-4-nitrobenzyl ester. Glutaric acid, isobutyl 3-methyl-4-nitrobenzyl ester. Sebacic acid, 3-methyl-4-nitrobenzyl propyl ester. Sebacic acid, ethyl 3-methyl-4-nitrobenzyl ester. Glutaric acid, di(3-methyl-4-nitrobenzyl) ester.

Find more compounds similar to Glutaric acid, 3-methyl-4-nitrobenzyl octyl ester.

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