Chloromethyl cyanide

• Formula: C₂H₂ClN
• Molecular weight: 75.497
• IUPAC Standard InChI: InChI=1S/C2H2ClN/c3-1-2-4/h1H2 Copy

  
• IUPAC Standard InChIKey: RENMDAKOXSCIGH-UHFFFAOYSA-N Copy
• CAS Registry Number: 107-14-2
• 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: Chloroacetonitrile; Acetonitrile, chloro-; α-Chloroacetonitrile; Chloracetonitrile; Monochloroacetonitrile; Monochloromethyl cyanide; 2-Chloroacetonitrile; CH2ClCN; Chloroethanenitrile; USAF KF-5; UN 2668; Acetonitrile, 2-chloro-; NSC 6180
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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)
  • Gas Chromatography
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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

C₂HClN^- +  =

By formula: C₂HClN^- + H⁺ = C₂H₂ClN

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.

Poutsma, Upshaw, et al., 2002
Poutsma, J.C.; Upshaw, S.D.; Squires, R.R.; Wenthold, P.G., Absolute heat of formation and singlet-triplet splitting for HCCN, J. Phys. Chem. A, 2002, 106, 6, 1067-1073, https://doi.org/10.1021/jp013653q . [all data]

Hacaloglu, Suzer, et al., 1988
Hacaloglu, J.; Suzer, S.; Oster, T.; Illenberger, E., Negative Ion Formation in Fluoroacetonitrile and Chloroacetonitrile following Low Energy Electron Impact, Chem. Phys. Lett., 1988, 153, 2-3, 268, https://doi.org/10.1016/0009-2614(88)85224-2 . [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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