Chemical Properties of Succinic acid, isobutyl 2-nitrobenzyl ester

Succinic acid, isobutyl 2-nitrobenzyl ester

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InChI
InChI=1S/C15H19NO6/c1-11(2)9-21-14(17)7-8-15(18)22-10-12-5-3-4-6-13(12)16(19)20/h3-6,11H,7-10H2,1-2H3
InChI Key
YVEKQJGVCCNOCB-UHFFFAOYSA-N
Formula
C15H19NO6
SMILES
CC(C)COC(=O)CCC(=O)OCc1ccccc1[N+](=O)[O-]
Molecular Weight1
309.31
Sources

Physical Properties

Property Value Unit Source
Δf -256.53 kJ/mol Joback Calculated Property
Δfgas -633.51 kJ/mol Joback Calculated Property
Δfus 41.67 kJ/mol Joback Calculated Property
Δvap 86.44 kJ/mol Joback Calculated Property
logPoct/wat 2.62 Crippen Calculated Property
Pc 2010.90 kPa Joback Calculated Property
Tboil 878.24 K Joback Calculated Property
Tc 1104.68 K Joback Calculated Property
Tfus 570.68 K Joback Calculated Property
Vc 0.89 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 698.81 J/mol×K 878.24 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Succinic acid, butyl 2-nitrobenzyl ester. Succinic acid, heptyl 2-nitrobenzyl ester. Succinic acid, 2-nitrobenzyl nonyl ester. Succinic acid, decyl 2-nitrobenzyl ester. Succinic acid, 2-nitrobenzyl octyl ester. Succinic acid, 2-methylhex-3-yl 2-nitrobenzyl ester. Succinic acid, hexyl 3-methyl-2-nitrobenzyl ester. Succinic acid, 3-methyl-2-nitrobenzyl undecyl ester. Succinic acid, 3-methyl-2-nitrobenzyl nonyl ester. Succinic acid, heptyl 3-methyl-2-nitrobenzyl ester. Succinic acid, dodecyl 3-methyl-2-nitrobenzyl ester. Succinic acid, 3-methyl-2-nitrobenzyl octyl ester. Succinic acid, decyl 3-methyl-2-nitrobenzyl ester. Glutaric acid, isobutyl 3-methyl-2-nitrobenzyl ester. Sebacic acid, isobutyl 3-methyl-2-nitrobenzyl ester.

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