Benzenamine, 4-(trifluoromethyl)-

• Formula: C₇H₆F₃N
• Molecular weight: 161.1244
• IUPAC Standard InChI: InChI=1S/C7H6F3N/c8-7(9,10)5-1-3-6(11)4-2-5/h1-4H,11H2 Copy

  
• IUPAC Standard InChIKey: ODGIMMLDVSWADK-UHFFFAOYSA-N Copy
• CAS Registry Number: 455-14-1
• 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: p-Aminobenzotrifluoride; 4-Aminobenzotrifluoride; 4-Amino-α,α,α-benzotrifluoride; p-Amino-α,α,α-trifluorotoluene; p-Toluidine, α,α,α-trifluoro-; p-(Trifluoromethyl)aniline; 4-(Trifluoromethyl)aniline; 4-(Trifluoromethyl)benzenamine; α,α,α-Trifluoro-p-toluidine; α,α,α-Trifluoro-p-anisidine; Aniline, p-(trifluoromethyl)-; 4-Aminobenzotrifluororide; 1-Amino-4-(trifluoromethyl)benzene; NSC 10337
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• Information on this page:
  • Reaction thermochemistry data
  • Gas phase ion energetics data
  • Gas Chromatography
  • References
  • Notes
• Other data available:
  • Phase change data
  • IR Spectrum
  • Mass spectrum (electron ionization)
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Reaction 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: John E. Bartmess

Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.

Individual Reactions

C₇H₅F₃N^- +  =

By formula: C₇H₅F₃N^- + H⁺ = C₇H₆F₃N

Gas phase ion energetics 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: John E. Bartmess

De-protonation reactions

C₇H₅F₃N^- +  =

By formula: C₇H₅F₃N^- + H⁺ = C₇H₆F₃N

Gas Chromatography

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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: NIST Mass Spectrometry Data Center, William E. Wallace, director

Van Den Dool and Kratz RI, non-polar column, temperature ramp

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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.

Bartmess, Scott, et al., 1979
Bartmess, J.E.; Scott, J.A.; McIver, R.T., Jr., The gas phase acidity scale from methanol to phenol, J. Am. Chem. Soc., 1979, 101, 6047. [all data]

Gautzsch and Zinn, 1996
Gautzsch, R.; Zinn, P., Use of incremental models to estimate the retention indexes of aromatic compounds, Chromatographia, 1996, 43, 3/4, 163-176, https://doi.org/10.1007/BF02292946 . [all data]

Notes

Go To: Top, Reaction thermochemistry data, Gas phase ion energetics data, Gas Chromatography, References

• Symbols used in this document:
  

  ΔrG°	Free energy of reaction at standard conditions
  ΔrH°	Enthalpy of reaction at standard conditions

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