Chemical Properties of 2,3,4,6-Tetrafluoronitrobenzene (CAS 314-41-0)

2,3,4,6-Tetrafluoronitrobenzene

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InChI
InChI=1S/C6HF4NO2/c7-2-1-3(8)6(11(12)13)5(10)4(2)9/h1H
InChI Key
FDLCUAUNAWWSBX-UHFFFAOYSA-N
Formula
C6HF4NO2
SMILES
O=[N+]([O-])c1c(F)cc(F)c(F)c1F
Molecular Weight1
195.07
CAS
314-41-0
Other Names
  • 1,2,3,5-tetrafluoro-4-nitrobenzene
  • Benzene, 1,2,3,5-tetrafluoro-4-nitro-
Sources

Physical Properties

Property Value Unit Source
Δf -670.16 kJ/mol Joback Calculated Property
Δfgas -771.72 kJ/mol Joback Calculated Property
Δfus 27.46 kJ/mol Joback Calculated Property
Δvap 47.20 kJ/mol Joback Calculated Property
logPoct/wat 2.15 Crippen Calculated Property
Pc 3497.14 kPa Joback Calculated Property
Tboil 351.50 ± 0.50 K NIST
Tc 741.46 K Joback Calculated Property
Tfus 379.85 K Joback Calculated Property
Vc 0.42 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 210.19 J/mol×K 532.2 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=C< (ring) 5
-NO2 1
-F 4
=CH- (ring) 1

Similar Compounds

Benzene, pentafluoronitro-. Benzene, 1,2,4-trifluoro-5-nitro-. 2,4-Difluoronitrobenzene. Benzene, 1,3-difluoro-4,6-dinitro-. 4-Bromo-2,5-difluoronitrobenzene. Benzene, 1-fluoro-2-nitro-. Benzene, 1-fluoro-3-nitro-. Benzenamine, 4-fluoro-3-nitro-. Benzenamine, 2,3,4,6-tetrafluoro-. Benzenamine, 2,3,4,5,6-pentafluoro-. Benzenamine, 2,3,4,5-tetrafluoro-. 2-Nitro-3,4,6-trifluoroacetanilide. 4-Fluoro-3-nitrotoluene. (Pentafluorophenyl)hydrazine. 3-FLUORO-4-NITROTOLUENE.

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