Benzenamine, 3-(methylthio)-

• Formula: C₇H₉NS
• Molecular weight: 139.218
• IUPAC Standard InChI: InChI=1S/C7H9NS/c1-9-7-4-2-3-6(8)5-7/h2-5H,8H2,1H3 Copy

  
• IUPAC Standard InChIKey: KCHLDNLIJVSRPK-UHFFFAOYSA-N Copy
• CAS Registry Number: 1783-81-9
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
  The 3d structure may be viewed using Java or Javascript.
• Other names: 3-(Methylthio)aniline; 3-Methylthiobenzenamine; 3-Methylmercaptoaniline; m-(Methylthio)aniline; m-Aminophenyl methyl sulfide; m-Aminothioanisole; Aniline, m-(methylthio)-; 3-Aminothioanisole; Aniline, 3-methylthio-; 3-CH3SC6H4NH2; 3-(Methylsulfanyl)phenylamine; NSC 66274
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• Information on this page:
  • Reaction thermochemistry data
  • Gas phase ion energetics data
  • 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

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Individual Reactions

C₇H₈NS^- +  =

By formula: C₇H₈NS^- + H⁺ = C₇H₉NS

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 evaluated as indicated in comments:
HL - Edward P. Hunter and Sharon G. Lias

Data compiled as indicated in comments:
B - John E. Bartmess

De-protonation reactions

C₇H₈NS^- +  =

By formula: C₇H₈NS^- + H⁺ = C₇H₉NS

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]

Hunter and Lias, 1998
Hunter, E.P.; Lias, S.G., Evaluated Gas Phase Basicities and Proton Affinities of Molecules: An Update, J. Phys. Chem. Ref. Data, 1998, 27, 3, 413-656, https://doi.org/10.1063/1.556018 . [all data]

Notes

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• 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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