Benzene, 1-chloro-2-nitro-4-(trifluoromethyl)-

• Formula: C₇H₃ClF₃NO₂
• Molecular weight: 225.552
• IUPAC Standard InChI: InChI=1S/C7H3ClF3NO2/c8-5-2-1-4(7(9,10)11)3-6(5)12(13)14/h1-3H Copy

  
• IUPAC Standard InChIKey: TZGFQIXRVUHDLE-UHFFFAOYSA-N Copy
• CAS Registry Number: 121-17-5
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
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• Other names: Toluene, 4-chloro-α,α,α-trifluoro-3-nitro-; 2-Nitro-4-(trifluoromethyl)chlorobenzene; 3-Nitro-4-(chloro)trifluoromethylbenzene; 4-Chloro-α,α,α-trifluoro-3-nitrotoluene; 4-Chloro-3-nitro-1-(trifluoromethyl)benzene; 4-Chloro-3-nitrobenzotrifluoride; 4-Chloro-3-nitro-α,α,α-trifluorotoluene; 3-Nitro-4-chlorobenzotrifluoride; 2-Chloro-5-(trifluoromethyl)nitrobenzene; 4-Chloro-3-nitrobenzylidyne fluoride; Toluene, 4-chloro-3-nitro-α,α,α-trifluoro-; Benzotrifluoride, 4-chloro-3-nitro-; 3-Nitro-4-chloro-α,α,α-trifluorotoluene; UN 2307; (3-Nitro-4-chlorophenyl)trifluoromethane; 1-Chloro-4-trifluoromethyl-2-nitrobenzene; NSC 8760
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• Information on this page:
  • Condensed phase thermochemistry data
  • References
  • Notes
• Other data available:
  • Phase change data
  • IR Spectrum
  • Mass spectrum (electron ionization)
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Condensed phase thermochemistry data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

References

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Gambaretto, Scipioni, et al., 1980
Gambaretto, G.; Scipioni, A.; Conte, L., Determination of the heats of formation and nitration of 3-nitro-4-chlorobenzotrifluoride and 3,5-dinitro-4-chlorobenzotrifluoride, Atti - Ist. Veneto Sci., Lett. Arti, Cl. Sci. Fis., Mat. Nat., 1980, 138, 189-194. [all data]

Notes

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• Symbols used in this document:
  

  ΔcH°solid	Enthalpy of combustion of solid at standard conditions
  ΔfH°solid	Enthalpy of formation of solid at standard conditions

• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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