Chemical Properties of Acetic acid, (4-fluoro-3-nitrophenyl)methyl ester

Acetic acid, (4-fluoro-3-nitrophenyl)methyl ester

InChI
InChI=1S/C9H8FNO4/c1-6(12)15-5-7-2-3-8(10)9(4-7)11(13)14/h2-4H,5H2,1H3
InChI Key
OHFZUFHGTANCOR-UHFFFAOYSA-N
Formula
C9H8FNO4
SMILES
CC(=O)OCc1ccc(F)c([N+](=O)[O-])c1
Molecular Weight1
213.16
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Physical Properties

Property Value Unit Source
ΔfusH° 31.14 kJ/mol Joback Calculated Property
ΔvapH° 76.64 kJ/mol Relay (1.0) Calculated Property
log10WS -2.79 Relay (1.0) Calculated Property
logPoct/wat 1.797 Crippen Calculated Property
McVol 140.540 ml/mol McGowan Calculated Property
Inp 1602.00 NIST
Tboil 533.76 K Relay (1.0) Calculated Property
Tfus 297.00 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 [350.60; 403.88] J/mol×K [651.49; 881.69] Show Hide
Cp,gas 350.60 J/mol×K 651.49 Joback Calculated Property
Cp,gas 361.50 J/mol×K 689.86 Joback Calculated Property
Cp,gas 371.57 J/mol×K 728.22 Joback Calculated Property
Cp,gas 380.83 J/mol×K 766.59 Joback Calculated Property
Cp,gas 389.30 J/mol×K 804.96 Joback Calculated Property
Cp,gas 396.97 J/mol×K 843.32 Joback Calculated Property
Cp,gas 403.88 J/mol×K 881.69 Joback Calculated Property

Similar Compounds

4-Fluoro-3-nitrobenzyl alcohol, chlorodifluoroacetate. Succinic acid, di(4-fluoro-3-nitrobenzyl) ester. Formic acid, (4-fluoro-3-nitrophenyl)methyl ester. Benzoic acid, (4-fluoro-3-nitrophenyl)methyl ester. Sebacic acid, ethyl 3-nitro-4-fluorobenzyl ester. Succinic acid, butyl 4-fluoro-3-nitrobenzyl ester. Succinic acid, 4-fluoro-3-nitrobenzyl isobutyl ester. Acetic acid, (4-chloro-3-nitrophenyl)methyl ester. Acetic acid, (2-fluoro-5-nitrophenyl)methyl ester. Acetic acid, (4-methyl-3-nitrophenyl)methyl ester. Sebacic acid, 3-nitro-4-fluorobenzyl propyl ester. Succinic acid, 4-fluoro-3-nitrobenzyl pentyl ester. Succinic acid, 4-fluoro-3-nitrobenzyl hexyl ester. Sebacic acid, butyl 3-nitro-4-fluorobenzyl ester. Sebacic acid, heptyl 3-nitro-4-fluorobenzyl ester.

Find more compounds similar to Acetic acid, (4-fluoro-3-nitrophenyl)methyl ester.

Sources

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