Butane, 2-chloro-2-methyl-

• Formula: C₅H₁₁Cl
• Molecular weight: 106.594
• IUPAC Standard InChI: InChI=1S/C5H11Cl/c1-4-5(2,3)6/h4H2,1-3H3 Copy

  
• IUPAC Standard InChIKey: CRNIHJHMEQZAAS-UHFFFAOYSA-N Copy
• CAS Registry Number: 594-36-5
• 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: tert-Amyl Chloride; tert-Pentyl Chloride; Tertiary pentyl chloride; 1,1-Dimethylpropyl chloride; 2-Chloro-2-methylbutane; 2-Methyl-2-chlorobutane
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• Information on this page:
  • Reaction thermochemistry data
  • IR Spectrum
  • References
  • Notes
• Other data available:
  • Condensed phase thermochemistry data
  • Phase change data
  • Henry's Law data
  • 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: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

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Individual Reactions

=

By formula: C₅H₁₁Cl = C₅H₁₁Cl

 +  =

By formula: C₅H₁₀ + HCl = C₅H₁₁Cl

 +  =

By formula: C₅H₁₀ + HCl = C₅H₁₁Cl

IR Spectrum

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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

Gas Phase Spectrum

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Additional Data

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.

Esipenok, Kabo, et al., 1973
Esipenok, G.E.; Kabo, G.Ya.; Andreevskii, D.N., Equilibrium and thermodynamics of the isomerisation of methylchlorobutanes, Russ. J. Phys. Chem. (Engl. Transl.), 1973, 47, 420. [all data]

Arnett and Pienta, 1980
Arnett, E.M.; Pienta, N.J., Stabilities of carbonium ions in solution. 12. Heats of formation of alkyl chlorides as an entree to heats of solvation of aliphatic carbonium ions, J. Am. Chem. Soc., 1980, 102, 3329-3334. [all data]

Notes

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• Symbols used in this document:
  

  ΔrH°	Enthalpy of reaction at standard conditions

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