Chemical Properties of Glutaric acid, butyl 4-nitrobenzyl ester

Glutaric acid, butyl 4-nitrobenzyl ester

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InChI
InChI=1S/C16H21NO6/c1-2-3-11-22-15(18)5-4-6-16(19)23-12-13-7-9-14(10-8-13)17(20)21/h7-10H,2-6,11-12H2,1H3
InChI Key
AKALDSUGBFSLAE-UHFFFAOYSA-N
Formula
C16H21NO6
SMILES
CCCCOC(=O)CCCC(=O)OCc1ccc([N+](=O)[O-])cc1
Molecular Weight1
323.34
Sources

Physical Properties

Property Value Unit Source
Δf -245.67 kJ/mol Joback Calculated Property
Δfgas -648.87 kJ/mol Joback Calculated Property
Δfus 47.78 kJ/mol Joback Calculated Property
Δvap 89.05 kJ/mol Joback Calculated Property
logPoct/wat 3.152 Crippen Calculated Property
Pc 1835.69 kPa Joback Calculated Property
Tboil 901.56 K Joback Calculated Property
Tc 1124.04 K Joback Calculated Property
Tfus 596.95 K Joback Calculated Property
Vc 0.954 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 754.95 J/mol×K 901.56 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
>C=O (nonring) 2
=CH- (ring) 4
-NO2 1
=C< (ring) 2
-CH2- 7
-CH3 1

Similar Compounds

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

Find more compounds similar to Glutaric acid, butyl 4-nitrobenzyl ester.

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