Chemical Properties of 2-Nitro-«alpha»,«alpha»,«alpha»-trifluorotoluene (CAS 384-22-5)

2-Nitro-«alpha»,«alpha»,«alpha»-trifluorotoluene

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InChI
InChI=1S/C7H4F3NO2/c8-7(9,10)5-3-1-2-4-6(5)11(12)13/h1-4H
InChI Key
NDZJSUCUYPZXPR-UHFFFAOYSA-N
Formula
C7H4F3NO2
SMILES
O=[N+]([O-])c1ccccc1C(F)(F)F
Molecular Weight1
191.11
CAS
384-22-5
Other Names
  • o-Nitrobenzotrifluoride
  • 2-Nitrobenzotrifluoride
  • Benzene, 1-nitro-2-(trifluoromethyl)-
  • Toluene, 2-nitro-«alpha»,«alpha»,«alpha»-trifluoro-
  • o-(Trifluoromethyl)nitrobenzene
  • Toluene, «alpha»,«alpha»,«alpha»-trifluoro-o-nitro-
  • 1-Nitro-2-(trifluoromethyl)benzene
  • «alpha»,«alpha»,«alpha»-Trifluoro-o-nitrotoluene
  • 2-(Trifluoromethyl)nitrobenzene
  • o-Nitro-«alpha»,«alpha»,«alpha»-trifluorotoluene
  • O-nitro-alpha,alpha,alpha-trifluorotoluene
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Physical Properties

Property Value Unit Source
EA 1.33 ± 0.10 eV NIST
Δf -435.20 kJ/mol Joback Calculated Property
Δfgas -570.59 kJ/mol Joback Calculated Property
Δfus 20.73 kJ/mol Joback Calculated Property
Δvap 46.96 kJ/mol Joback Calculated Property
log10WS -3.23 Crippen Calculated Property
logPoct/wat 2.614 Crippen Calculated Property
McVol 108.460 ml/mol McGowan Calculated Property
Pc 3551.53 kPa Joback Calculated Property
Tboil 537.64 K Joback Calculated Property
Tc 764.81 K Joback Calculated Property
Tfus 355.39 K Joback Calculated Property
Vc 0.445 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [250.24; 299.22] J/mol×K [537.64; 764.81] Show Hide
Cp,gas 250.24 J/mol×K 537.64 Joback Calculated Property
Cp,gas 260.42 J/mol×K 575.50 Joback Calculated Property
Cp,gas 269.71 J/mol×K 613.36 Joback Calculated Property
Cp,gas 278.17 J/mol×K 651.23 Joback Calculated Property
Cp,gas 285.87 J/mol×K 689.09 Joback Calculated Property
Cp,gas 292.87 J/mol×K 726.95 Joback Calculated Property
Cp,gas 299.22 J/mol×K 764.81 Joback Calculated Property

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 377.70 K 2.70 NIST

Similar Compounds

5-Bromo-2-nitrobenzotrifluoride. 5-Chloro-2-nitrobenzotrifluoride. 5-Amino-2-nitrobenzotrifluoride. Benzene, 1-nitro-3-(trifluoromethyl)-. 4-Nitro-3-(trifluoromethyl)phenol. 3-Trifluoromethyl-N,N-dimethyl-4-nitroaniline. 4-Cyano-3-nitrobenzotrifluoride. Benzonitrile, 2-nitro-. 2-Amino-5-nitrobenzotrifluoride. Benzene, 1-methyl-2-nitro-. 4-Nitro-«alpha»,«alpha»,«alpha»-trifluorotoluene. Benzenamine, 2-(trifluoromethyl)-. o-Nitrobenzoyl chloride. Benzene, 1-isocyanato-2-(trifluoromethyl)-. 2-Trifluoromethyl-N,N-dimethyl-4-nitroaniline.

Find more compounds similar to 2-Nitro-«alpha»,«alpha»,«alpha»-trifluorotoluene.

Sources

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