Chemical Properties of 2-Fluoro-6-trifluoromethylbenzoic acid, 4-nitrophenyl ester

2-Fluoro-6-trifluoromethylbenzoic acid, 4-nitrophenyl ester

InChI
InChI=1S/C14H7F4NO4/c15-11-3-1-2-10(14(16,17)18)12(11)13(20)23-9-6-4-8(5-7-9)19(21)22/h1-7H
InChI Key
GIQWXHMRPQOIMN-UHFFFAOYSA-N
Formula
C14H7F4NO4
SMILES
O=C(Oc1ccc([N+](=O)[O-])cc1)c1c(F)cccc1C(F)(F)F
Molecular Weight1
329.20
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Physical Properties

Property Value Unit Source
ΔfusH° 39.57 kJ/mol Joback Calculated Property
IE 9.54 eV Relay (1.0) Calculated Property
logPoct/wat 3.972 Crippen Calculated Property
McVol 192.540 ml/mol McGowan Calculated Property
Inp [2043.00; 2043.00]   Show Hide
Inp 2043.00 NIST
Inp 2043.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [270.46; 579.52] 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 A-3.96000e+00
Coefficient B1.21506e+00
Coefficient C-8.20280e-04
Coefficient D1.88700e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 270.46 J/mol×K 273.00 Calculated Property
Cp,gas 331.59 J/mol×K 353.78 Calculated Property
Cp,gas 384.64 J/mol×K 434.56 Calculated Property
Cp,gas 430.19 J/mol×K 515.33 Calculated Property
Cp,gas 468.84 J/mol×K 596.11 Calculated Property
Cp,gas 501.19 J/mol×K 676.89 Calculated Property
Cp,gas 527.84 J/mol×K 757.67 Calculated Property
Cp,gas 549.38 J/mol×K 838.44 Calculated Property
Cp,gas 566.40 J/mol×K 919.22 Calculated Property
Cp,gas 579.52 J/mol×K 1000.00 Calculated Property

Similar Compounds

2-Fluoro-6-trifluoromethylbenzoic acid, phenyl ester. 6-Fluoro-2-trifluoromethylbenzoic acid, 3-fluorophenyl ester. 2-Fluoro-6-trifluoromethylbenzoic acid, 4-cyanophenyl ester. 2-Fluoro-6-trifluoromethylbenzoic acid, 4-chlorophenyl ester. 2-Fluoro-6-trifluoromethylbenzoic acid, 4-methoxyphenyl ester. 5-Fluoro-2-trifluoromethylbenzoic acid, 4-nitrophenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 4-nitrophenyl ester. 2-Fluoro-6-trifluoromethylbenzoic acid, 3-methylphenyl ester. 2-Fluoro-6-trifluoromethylbenzoic acid, 3,4-dichlorophenyl ester. 2-Fluoro-6-trifluoromethylbenzoic acid, 3,5-difluophenyl ester. 2-Fluoro-6-trifluoromethylbenzoic acid, 4-benzyloxyphenyl ester. 6-Fluoro-2-trifluoromethylbenzoic acid, 3,4-dimethylphenyl ester. 2-Fluoro-3-trifluoromethylbenzoic acid, 4-nitrophenyl ester. 6-Fluoro-2-trifluoromethylbenzoic acid, 2,3-dichlorophenyl ester. 6-Fluoro-2-trifluoromethylbenzoic acid, 4-isopropylphenyl ester.

Find more compounds similar to 2-Fluoro-6-trifluoromethylbenzoic acid, 4-nitrophenyl ester.

Sources

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