Chemical Properties of Glutaric acid, hexyl 3-nitrophenyl ester

Glutaric acid, hexyl 3-nitrophenyl ester

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InChI
InChI=1S/C17H23NO6/c1-2-3-4-5-12-23-16(19)10-7-11-17(20)24-15-9-6-8-14(13-15)18(21)22/h6,8-9,13H,2-5,7,10-12H2,1H3
InChI Key
JVDUVJFERONCCW-UHFFFAOYSA-N
Formula
C17H23NO6
SMILES
CCCCCCOC(=O)CCCC(=O)Oc1cccc([N+](=O)[O-])c1
Molecular Weight1
337.37
Sources

Physical Properties

Property Value Unit Source
Δf -237.25 kJ/mol Joback Calculated Property
Δfgas -669.51 kJ/mol Joback Calculated Property
Δfus 50.37 kJ/mol Joback Calculated Property
Δvap 91.28 kJ/mol Joback Calculated Property
logPoct/wat 3.79 Crippen Calculated Property
Pc 1693.51 kPa Joback Calculated Property
Tboil 924.44 K Joback Calculated Property
Tc 1146.52 K Joback Calculated Property
Tfus 608.22 K Joback Calculated Property
Vc 1.01 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 812.38 J/mol×K 924.44 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- 8
-CH3 1

Similar Compounds

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

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