Chemical Properties of Benzoic acid, (2-fluoro-5-nitrophenyl)methyl ester

Benzoic acid, (2-fluoro-5-nitrophenyl)methyl ester

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InChI
InChI=1S/C14H10FNO4/c15-13-7-6-12(16(18)19)8-11(13)9-20-14(17)10-4-2-1-3-5-10/h1-8H,9H2
InChI Key
WTPUBICIJXMFPS-UHFFFAOYSA-N
Formula
C14H10FNO4
SMILES
O=C(OCc1cc([N+](=O)[O-])ccc1F)c1ccccc1
Molecular Weight1
275.23
Sources

Physical Properties

Property Value Unit Source
Δf -120.62 kJ/mol Joback Calculated Property
Δfgas -333.84 kJ/mol Joback Calculated Property
Δfus 36.55 kJ/mol Joback Calculated Property
Δvap 77.56 kJ/mol Joback Calculated Property
logPoct/wat 3.09 Crippen Calculated Property
Pc 2721.17 kPa Joback Calculated Property
Tboil 810.44 K Joback Calculated Property
Tc 1061.68 K Joback Calculated Property
Tfus 541.78 K Joback Calculated Property
Vc 0.73 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 516.51 J/mol×K 810.44 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Acetic acid, (2-fluoro-5-nitrophenyl)methyl ester. Benzoic acid, (4-fluoro-3-nitrophenyl)methyl ester. Glutaric acid, di(2-fluoro-5-nitrobenzyl) ester. Benzoic acid, (4-methyl-3-nitrophenyl)methyl ester. Benzoic acid, (4-chloro-3-nitrophenyl)methyl ester. Benzoic acid, (2-chloro-5-nitrophenyl)methyl ester. Terephthalic acid, ethyl 3-nitro-4-methylbenzyl ester. Benzoic acid, (2-methyl-3-nitrophenyl)methyl ester. Terephthalic acid, 3-nitro-4-methylbenzyl propyl ester. 3-O2N-C6H4-COOCH3. Terephthalic acid, isobutyl 3-nitro-4-methylbenzyl ester. Benzoic acid, (4-methoxy-3-nitrophenyl)methyl ester. Ethyl 3-nitrobenzoate. Benzoic acid, 3,5-dinitro, 1-phenylethyl ester. Benzoic acid, (2-fluorophenyl)methyl ester.

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

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