Chemical Properties of Glutaric acid, di(3-nitrobenzyl) ester

Glutaric acid, di(3-nitrobenzyl) ester

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InChI
InChI=1S/C19H18N2O8/c22-18(28-12-14-4-1-6-16(10-14)20(24)25)8-3-9-19(23)29-13-15-5-2-7-17(11-15)21(26)27/h1-2,4-7,10-11H,3,8-9,12-13H2
InChI Key
PVDBONOUGHIODU-UHFFFAOYSA-N
Formula
C19H18N2O8
SMILES
O=C(CCCC(=O)OCc1cccc([N+](=O)[O-])c1)OCc1cccc([N+](=O)[O-])c1
Molecular Weight1
402.35
Sources

Physical Properties

Property Value Unit Source
Δf -82.08 kJ/mol Joback Calculated Property
Δfgas -496.49 kJ/mol Joback Calculated Property
Δfus 60.57 kJ/mol Joback Calculated Property
Δvap 115.26 kJ/mol Joback Calculated Property
logPoct/wat 3.46 Crippen Calculated Property
Pc 1900.26 kPa Joback Calculated Property
Tboil 1153.70 K Joback Calculated Property
Tc 1420.54 K Joback Calculated Property
Tfus 813.31 K Joback Calculated Property
Vc 1.10 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 893.89 J/mol×K 1153.7 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
=CH- (ring) 8
-NO2 2
=C< (ring) 4
-CH2- 5
>C=O (nonring) 2

Similar Compounds

Glutaric acid, ethyl 3-nitrobenzyl ester. Glutaric acid, 3-nitrobenzyl propyl ester. Glutaric acid, butyl 3-nitrobenzyl ester. Glutaric acid, 3-nitrobenzyl pentyl ester. Glutaric acid, hexyl 3-nitrobenzyl ester. Glutaric acid, isobutyl 3-nitrobenzyl ester. Glutaric acid, heptyl 3-nitrobenzyl ester. Glutaric acid, 3-nitrobenzyl nonyl ester. Glutaric acid, decyl 3-nitrobenzyl ester. Glutaric acid, 3-nitrobenzyl octyl ester. (3-Nitrophenyl) methanol, n-pentyl ether. Glutaric acid, 2-ethylhexyl 3-nitrobenzyl ester. Glutaric acid, cyclohexylmethyl 3-nitrobenzyl ester. Glutaric acid, dec-2-yl 3-nitrobenzyl ester. Succinic acid, butyl 3-nitrobenzyl ester.

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