Chemical Properties of Formic acid, (2-chloro-5-nitrophenyl)methyl ester

Formic acid, (2-chloro-5-nitrophenyl)methyl ester

InChI
InChI=1S/C8H6ClNO4/c9-8-2-1-7(10(12)13)3-6(8)4-14-5-11/h1-3,5H,4H2
InChI Key
SKGAPYJBJWXFLP-UHFFFAOYSA-N
Formula
C8H6ClNO4
SMILES
O=COCc1cc([N+](=O)[O-])ccc1Cl
Molecular Weight1
215.59
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Physical Properties

Property Value Unit Source
ΔfusH° 31.35 kJ/mol Joback Calculated Property
ΔvapH° 83.37 kJ/mol Relay (1.0) Calculated Property
log10WS -3.16 Relay (1.0) Calculated Property
logPoct/wat 1.921 Crippen Calculated Property
McVol 136.920 ml/mol McGowan Calculated Property
Inp 1683.00 NIST
Tboil 566.73 K Relay (1.0) Calculated Property
Tfus 335.95 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [304.12; 344.23] J/mol×K [666.07; 911.82] Show Hide
Cp,gas 304.12 J/mol×K 666.07 Joback Calculated Property
Cp,gas 312.48 J/mol×K 707.03 Joback Calculated Property
Cp,gas 320.10 J/mol×K 747.99 Joback Calculated Property
Cp,gas 327.02 J/mol×K 788.94 Joback Calculated Property
Cp,gas 333.31 J/mol×K 829.90 Joback Calculated Property
Cp,gas 339.03 J/mol×K 870.86 Joback Calculated Property
Cp,gas 344.23 J/mol×K 911.82 Joback Calculated Property

Similar Compounds

Acetic acid, (2-chloro-5-nitrophenyl)methyl ester. Benzoic acid, (2-chloro-5-nitrophenyl)methyl ester. 2-Chloro-5-nitrobenzyl alcohol, isopropyl ether. 2-Chloro-5-nitrobenzyl alcohol, chlorodifluoroacetate. 2-Chloro-5-nitrobenzyl alcohol, n-propyl ether. 2-Chloro-5-nitrobenzyl alcohol, 2-methylpropyl ether. 2-Chloro-5-nitrobenzyl alcohol, 1-methylpropyl ether. 2-Chloro-5-nitrobenzyl alcohol, n-butyl ether. 2-Chloro-5-nitrobenzyl alcohol, n-pentyl ether. 2-Chloro-5-nitrobenzyl alcohol, 3-methylbutyl ether. 2-Chloro-5-nitrobenzyl alcohol, 2-methylbutyl ether. Formic acid, (4-chloro-3-nitrophenyl)methyl ester. Formic acid, (2-fluoro-5-nitrophenyl)methyl ester. Ether, bis(m-nitrobenzyl)-. (3-Nitrophenyl) methanol, ethyl ether.

Find more compounds similar to Formic acid, (2-chloro-5-nitrophenyl)methyl ester.

Sources

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