Chemical Properties of 3-Chlorobenzoic acid, 2-nitro-5-fluorophenyl ester

3-Chlorobenzoic acid, 2-nitro-5-fluorophenyl ester

InChI
InChI=1S/C13H7ClFNO4/c14-9-3-1-2-8(6-9)13(17)20-12-7-10(15)4-5-11(12)16(18)19/h1-7H
InChI Key
SSRSDIPPPNHLEQ-UHFFFAOYSA-N
Formula
C13H7ClFNO4
SMILES
O=C(Oc1cc(F)ccc1[N+](=O)[O-])c1cccc(Cl)c1
Molecular Weight1
295.65
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Physical Properties

Property Value Unit Source
ΔfusH° 39.35 kJ/mol Joback Calculated Property
logPoct/wat 3.607 Crippen Calculated Property
McVol 185.380 ml/mol McGowan Calculated Property
Inp [2183.00; 2183.00]   Show Hide
Inp 2183.00 NIST
Inp 2183.00 NIST
Tboil 612.14 K Relay (1.0) Calculated Property

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [239.51; 513.52] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A1.60400e+01
Coefficient B9.65660e-01
Coefficient C-5.65280e-04
Coefficient D9.71000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 239.51 J/mol×K 273.00 Calculated Property
Cp,gas 291.22 J/mol×K 353.78 Calculated Property
Cp,gas 336.89 J/mol×K 434.56 Calculated Property
Cp,gas 376.85 J/mol×K 515.33 Calculated Property
Cp,gas 411.38 J/mol×K 596.11 Calculated Property
Cp,gas 440.80 J/mol×K 676.89 Calculated Property
Cp,gas 465.42 J/mol×K 757.67 Calculated Property
Cp,gas 485.54 J/mol×K 838.44 Calculated Property
Cp,gas 501.47 J/mol×K 919.22 Calculated Property
Cp,gas 513.52 J/mol×K 1000.00 Calculated Property

Similar Compounds

3-Chloro-2-fluorobenzoic acid, 2-nitro-5-fluorophenyl ester. 4-Cyanobenzoic acid, 5-fluoro-2-nitrophenyl ester. 3-Bromobenzoic acid, 5-fluoro-2-nitrophenyl ester. m-Methoxybenzoic acid, 5-fluoro-2-nitrophenyl ester. p-Toluic acid, 5-fluoro-2-nitrophenyl ester. p-Methoxybenzoic acid, 5-fluoro-2-nitrophenyl ester. 2,5-Difluorobenzoic acid, 2-nitro-5-fluorophenyl ester. o-Methoxybenzoic acid, 5-fluoro-2-nitrophenyl ester. 2,4-Difluorobenzoic acid, 2-nitro-5-fluorophenyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 2-nitro-5-fluorophenyl ester. Isophthalic acid, ethyl 2-nitro-5-fluorophenyl ester. 2-Fluoro-3-trifluoromethylbenzoic acid, 2-nitro-5-fluorophenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 2-nitro-5-fluorophenyl ester. Isophthalic acid, 2-nitro-5-fluorophenyl propyl ester. 3-Fluoro-5-trifluoromethylbenzoic acid, 2-nitro-5-fluorophenyl ester.

Find more compounds similar to 3-Chlorobenzoic acid, 2-nitro-5-fluorophenyl ester.

Sources

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