Chemical Properties of Acetic acid, (2-methyl-3-nitrophenyl)methyl ester

Acetic acid, (2-methyl-3-nitrophenyl)methyl ester

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InChI
InChI=1S/C10H11NO4/c1-7-9(6-15-8(2)12)4-3-5-10(7)11(13)14/h3-5H,6H2,1-2H3
InChI Key
LNLRTUUUVJCCQG-UHFFFAOYSA-N
Formula
C10H11NO4
SMILES
CC(=O)OCc1cccc([N+](=O)[O-])c1C
Molecular Weight1
209.20
Sources

Physical Properties

Property Value Unit Source
Δf -71.90 kJ/mol Joback Calculated Property
Δfgas -291.70 kJ/mol Joback Calculated Property
Δfus 29.07 kJ/mol Joback Calculated Property
Δvap 67.20 kJ/mol Joback Calculated Property
logPoct/wat 1.97 Crippen Calculated Property
Pc 3022.28 kPa Joback Calculated Property
Tboil 692.97 K Joback Calculated Property
Tc 931.12 K Joback Calculated Property
Tfus 469.69 K Joback Calculated Property
Vc 0.59 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 393.70 J/mol×K 692.97 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
>C=O (nonring) 1
=CH- (ring) 3
-NO2 1
=C< (ring) 3
-CH2- 1
-CH3 2

Similar Compounds

Formic acid, (2-methyl-3-nitrophenyl)methyl ester. Succinic acid, 2-methyl-3-nitrobenzyl propyl ester. Sebacic acid, 2-methyl-3-nitrobenzyl propyl ester. Sebacic acid, butyl 2-methyl-3-nitrobenzyl ester. Sebacic acid, 2-methyl-3-nitrobenzyl pentyl ester. Sebacic acid, hexyl 2-methyl-3-nitrobenzyl ester. Sebacic acid, isobutyl 2-methyl-3-nitrobenzyl ester. Benzoic acid, (2-methyl-3-nitrophenyl)methyl ester. Acetic acid, (4-methyl-3-nitrophenyl)methyl ester. Glutaric acid, 3,5-dinitro-2-methylbenzyl ethyl ester. Glutaric acid, butyl 3,5-dinitro-2-methylbenzyl ester. Glutaric acid, 3,5-dinitro-2-methylbenzyl pentyl ester. Glutaric acid, 3,5-dinitro-2-methylbenzyl isobutyl ester. Glutaric acid, 3,5-dinitro-2-methylbenzyl hexyl ester. Glutaric acid, 3,5-dinitro-2-methylbenzyl heptyl ester.

Find more compounds similar to Acetic acid, (2-methyl-3-nitrophenyl)methyl ester.

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