1-Propene, 3-chloro-2-methyl-

• Formula: C₄H₇Cl
• Molecular weight: 90.551
• IUPAC Standard InChI: InChI=1S/C4H7Cl/c1-4(2)3-5/h1,3H2,2H3 Copy

  
• IUPAC Standard InChIKey: OHXAOPZTJOUYKM-UHFFFAOYSA-N Copy
• CAS Registry Number: 563-47-3
• 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: Propene, 3-chloro-2-methyl-; β-Methallyl chloride; γ-Chloroisobutylene; Isobutenyl chloride; Methallyl chloride; Methylallyl chloride; 2-Methyl-2-propenyl chloride; 2-Methylallyl chloride; 3-Chloro-2-methylpropene; 3-Chloro-2-methyl-1-propene; 3-Chloro-2-methylpropene-1; β-Methylallyl chloride; Chlorure de methallyle; Cloruro di metallile; NCI-C54820; 2-Methyl-allylchlorid; 3-Chlor-2-methyl-prop-1-en; 3-Cloro-2-metil-prop-1-ene; 1-Chloro-2-methyl-2-propene; UN 2554; 2-Methallyl chloride; NSC 7303
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• Information on this page:
  • Phase change data
  • Reaction thermochemistry data
  • IR Spectrum
  • Mass spectrum (electron ionization)
  • References
  • Notes
• Other data available:
  • Gas Chromatography
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  • Gas Phase Kinetics Database
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Phase change 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 as indicated in comments:
BS - Robert L. Brown and Stephen E. Stein
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
AC - William E. Acree, Jr., James S. Chickos

Enthalpy of vaporization

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

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

=  + 

By formula: C₄H₈Cl₂ = C₄H₇Cl + HCl

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

Mass spectrum (electron ionization)

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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

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.

Weast and Grasselli, 1989
CRC Handbook of Data on Organic Compounds, 2nd Editon, Weast,R.C and Grasselli, J.G., ed(s)., CRC Press, Inc., Boca Raton, FL, 1989, 1. [all data]

Vernon, 1954
Vernon, C.A., J. Chem. Soc., 1954, 1954, 423. [all data]

Henne, Shepard, et al., 1950
Henne, A.L.; Shepard, J.W.; Young, E.J., J. Am. Chem. Soc., 1950, 72, 3577. [all data]

Hatch and Alexander, 1949
Hatch, L.F.; Alexander, H.E., Allylic Chlorides V. Relative Reactivities with Sodium Ethoxide in Ethanol, J. Am. Chem. Soc., 1949, 71, 1037. [all data]

Hatch, Gordon, et al., 1948
Hatch, L.F.; Gordon, L.B.; Russ, J.J., J. Am. Chem. Soc., 1948, 70, 1093. [all data]

Stephenson and Malanowski, 1987
Stephenson, Richard M.; Malanowski, Stanislaw, Handbook of the Thermodynamics of Organic Compounds, 1987, https://doi.org/10.1007/978-94-009-3173-2 . [all data]

Levanova, Rozhnov, et al., 1975
Levanova, S.V.; Rozhnov, A.M.; Plaksina, T.V.; Anisimova, Z.I., Dehydrohalogenation of some dihalo derivatives of isobutane, Russ. J. Phys. Chem. (Engl. Transl.), 1975, 49, 1440-1441. [all data]

Notes

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• Symbols used in this document:
  

  Tboil	Boiling point
  Tfus	Fusion (melting) point
  ΔrH°	Enthalpy of reaction at standard conditions
  ΔvapH	Enthalpy of vaporization

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