3-Methylbenzyl cyanide

• Formula: C₉H₉N
• Molecular weight: 131.1745
• IUPAC Standard InChI: InChI=1S/C9H9N/c1-8-3-2-4-9(7-8)5-6-10/h2-4,7H,5H2,1H3 Copy

  
• IUPAC Standard InChIKey: WOJADIOTNFDWNQ-UHFFFAOYSA-N Copy
• CAS Registry Number: 2947-60-6
• 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: m-Xylyl cyanide; m-Methylbenzyl cyanide; m-Tolylacetonitrile; m-Methylphenylacetonitrile; 3-Tolylacetonitrile; 3-Methylphenylacetonitrile; Benzeneacetonitrile, 3-methyl-; NSC 20695; 3-Tolylacetic acid nitrile
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• Information on this page:
  • Reaction thermochemistry data
  • References
  • Notes
• Other data available:
  • Phase change data
  • Gas phase ion energetics 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

C₉H₈N^- +  =

By formula: C₉H₈N^- + H⁺ = C₉H₉N

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.

Taft and Topsom, 1987
Taft, R.W.; Topsom, R.D., The Nature and Analysis of Substituent Effects, Prog. Phys. Org. Chem., 1987, 16, 1. [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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