Methane, chloromethoxy-

• Formula: C₂H₅ClO
• Molecular weight: 80.513
• IUPAC Standard InChI: InChI=1S/C2H5ClO/c1-4-2-3/h2H2,1H3 Copy

  
• IUPAC Standard InChIKey: XJUZRXYOEPSWMB-UHFFFAOYSA-N Copy
• CAS Registry Number: 107-30-2
• 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: Ether, chloromethyl methyl; Chlorodimethyl ether; Chloromethoxymethane; Chloromethyl methyl ether; Methoxychloromethane; Methoxymethyl chloride; Methyl chloromethyl ether; Monochlorodimethyl ether; Monochloromethyl methyl ether; CH3OCH2Cl; Chlormethyl methyl ether; Chlordimethylether; CMME; Ether methylique monochlore; Ether, dimethyl chloro; Methyl chloromethyl ether, anhydrous; Rcra waste number U046; UN 1239; NSC 21208
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• Information on this page:
  • Gas phase ion energetics data
  • Gas Chromatography
  • References
  • Notes
• Other data available:
  • Phase change data
  • Reaction thermochemistry data
  • IR Spectrum
  • Mass spectrum (electron ionization)
• Data at other public NIST sites:
  • Gas Phase Kinetics Database
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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 compiled as indicated in comments:
B - John E. Bartmess
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron

Ionization energy determinations

Appearance energy determinations

De-protonation reactions

C₂H₄ClO^- +  =

By formula: C₂H₄ClO^- + H⁺ = C₂H₅ClO

Gas Chromatography

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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

Normal alkane RI, non-polar column, temperature ramp

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Normal alkane RI, non-polar column, custom temperature program

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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.

Vereschagin, Salikova, et al., 1980
Vereschagin, A.N.; Salikova, A.M.; Zverev, V.V.; Saitkulova, F.G.; Villem, Y.Y., Physical properties, conformations, and intramolecular interactions of α, α-dichlorodimethyl ether, Bull. Acad. Sci. USSR, Div. Chem. Sci., 1980, 997. [all data]

Haney and Franklin, 1969
Haney, M.A.; Franklin, J.L., Excess energies in mass spectra of some oxygen-containing organic compounds, J. Chem. Soc. Faraday Trans., 1969, 65, 1794. [all data]

Paulino and Squires, 1991
Paulino, J.A.; Squires, R.R., Carbene Anion Complexes - Unusual Structural and Thermochemical Features of alpha-Halocarbanions in the Gas Phase, J. Am. Chem. Soc., 1991, 113, 5, 1845, https://doi.org/10.1021/ja00005a067 . [all data]

Zenkevich, Eliseenkov, et al., 2011
Zenkevich, I.G.; Eliseenkov, E.V.; Kasatochkin, A.N.; Ukolov, A.I., Identification of the products of nonregioselective organic reactions by chromatography - mass spectrometry: chloro derivatives of dialkyl ethers, Rus. J. Anal. Chem., 2011, 66, 14, 1445-1454, https://doi.org/10.1134/S1061934811140218 . [all data]

Zenkevich, 2005
Zenkevich, I.G., Experimentally measured retention indices., 2005. [all data]

Waggott and Davies, 1984
Waggott, A.; Davies, I.W., Identification of organic pollutants using linear temperature programmed retention indices (LTPRIs) - Part II, 1984, retrieved from http://dwi.defra.gov.uk/research/completed-research/reports/dwi0383.pdf. [all data]

Notes

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• Symbols used in this document:
  

  AE	Appearance energy
  ΔrG°	Free energy of reaction at standard conditions

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