Chemical Properties of Glutaric acid, 3-nitrophenyl pentyl ester

Glutaric acid, 3-nitrophenyl pentyl ester

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InChI
InChI=1S/C16H21NO6/c1-2-3-4-11-22-15(18)9-6-10-16(19)23-14-8-5-7-13(12-14)17(20)21/h5,7-8,12H,2-4,6,9-11H2,1H3
InChI Key
IAIZGNSHNHMYOI-UHFFFAOYSA-N
Formula
C16H21NO6
SMILES
CCCCCOC(=O)CCCC(=O)Oc1cccc([N+](=O)[O-])c1
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 3.40 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 0.95 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
-CH3 1
=CH- (ring) 4
-NO2 1
=C< (ring) 2
-CH2- 7
>C=O (nonring) 2

Similar Compounds

Glutaric acid, butyl 3-nitrophenyl ester. Glutaric acid, 3-nitrophenyl propyl ester. Glutaric acid, hexyl 3-nitrophenyl ester. Glutaric acid, ethyl 3-nitrophenyl ester. Glutaric acid, isohexyl 3-nitrophenyl ester. Glutaric acid, 3-nitrophenyl tetradecyl ester. Glutaric acid, 3-nitrophenyl octyl ester. Glutaric acid, 3-nitrophenyl nonyl ester. Glutaric acid, heptyl 3-nitrophenyl ester. Glutaric acid, 3-nitrophenyl undecyl ester. Glutaric acid, dodecyl 3-nitrophenyl ester. Glutaric acid, decyl 3-nitrophenyl ester. Glutaric acid, 3-nitrophenyl tridecyl ester. Glutaric acid, isobutyl 3-nitrophenyl ester. Sebacic acid, butyl 3-nitrophenyl ester.

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