Chemical Properties of Phthalic acid, butyl 2-(2-nitrophenyl)ethyl ester

Phthalic acid, butyl 2-(2-nitrophenyl)ethyl ester

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InChI
InChI=1S/C20H21NO6/c1-2-3-13-26-19(22)16-9-5-6-10-17(16)20(23)27-14-12-15-8-4-7-11-18(15)21(24)25/h4-11H,2-3,12-14H2,1H3
InChI Key
MPEMNHVDPNTZMH-UHFFFAOYSA-N
Formula
C20H21NO6
SMILES
CCCCOC(=O)c1ccccc1C(=O)OCCc1ccccc1[N+](=O)[O-]
Molecular Weight1
371.38
Sources

Physical Properties

Property Value Unit Source
Δf -109.21 kJ/mol Joback Calculated Property
Δfgas -506.37 kJ/mol Joback Calculated Property
Δfus 51.79 kJ/mol Joback Calculated Property
Δvap 100.89 kJ/mol Joback Calculated Property
logPoct/wat 3.95 Crippen Calculated Property
Pc 1733.22 kPa Joback Calculated Property
Tboil 1024.74 K Joback Calculated Property
Tc 1269.43 K Joback Calculated Property
Tfus 680.97 K Joback Calculated Property
Vc 1.07 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 875.97 J/mol×K 1024.74 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
>C=O (nonring) 2
=CH- (ring) 8
-NO2 1
=C< (ring) 4
-CH2- 5
-CH3 1

Similar Compounds

Phthalic acid, 2-(2-nitrophenyl)ethyl pentyl ester. Phthalic acid, 2-(2-nitrophenyl)ethyl propyl ester. Phthalic acid, hexyl 2-(2-nitrophenyl)ethyl ester. Phthalic acid, isobutyl 2-(2-nitrophenyl)ethyl ester. Phthalic acid, heptyl 2-(2-nitrophenyl)ethyl ester. Phthalic acid, 2-(2-nitrophenyl)ethyl nonyl ester. Phthalic acid, decyl 2-(2-nitrophenyl)ethyl ester. Phthalic acid, 2-(2-nitrophenyl)ethyl octyl ester. Phthalic acid, ethyl 2-(2-nitrophenyl)ethyl ester. Benzoic acid, 2-(2-nitrophenyl)ethyl ester. Phthalic acid, 4-methyl-3-nitrobenzyl pentyl ester. Phthalic acid, hexyl 4-methyl-3-nitrobenzyl ester. Phthalic acid, heptyl 4-methyl-3-nitrobenzyl ester. Phthalic acid, 4-methyl-3-nitrobenzyl nonyl ester. Phthalic acid, 4-methyl-3-nitrobenzyl octyl ester.

Find more compounds similar to Phthalic acid, butyl 2-(2-nitrophenyl)ethyl ester.

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