2,4-Dimethylfuran

• Formula: C₆H₈O
• Molecular weight: 96.1271
• IUPAC Standard InChI: InChI=1S/C6H8O/c1-5-3-6(2)7-4-5/h3-4H,1-2H3 Copy

  
• IUPAC Standard InChIKey: AABTWRKUKUPMJG-UHFFFAOYSA-N Copy
• CAS Registry Number: 3710-43-8
• 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: Furan, 2,4-dimethyl-
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• Information on this page:
  • Phase change data
  • Gas phase ion energetics data
  • Mass spectrum (electron ionization)
  • References
  • Notes
• Other data available:
  • Gas Chromatography
• Data at other public NIST sites:
  • Gas Phase Kinetics Database
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Phase change data

Go To: Top, Gas phase ion energetics data, Mass spectrum (electron ionization), References, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director

Gas phase ion energetics data

Go To: Top, Phase change data, Mass spectrum (electron ionization), References, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data evaluated as indicated in comments:
HL - Edward P. Hunter and Sharon G. Lias

Data compiled as indicated in comments:
LBLHLM - Sharon G. Lias, John E. Bartmess, Joel F. Liebman, John L. Holmes, Rhoda D. Levin, and W. Gary Mallard

View reactions leading to C₆H₈O⁺ (ion structure unspecified)

Ionization energy determinations

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

Go To: Top, Phase change data, Gas phase ion energetics data, Mass spectrum (electron ionization), Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Scharf and Walters, 1978
Scharf, H.-D.; Walters, E., A New Synthesis Principle for Furane Derivatives II. Fragmentation and Recycling Condensation of 1,3-Dioxolane-4-ylium Ions, Chem. Ber., 1978, 111, 639. [all data]

Schreurs, de Jong, et al., 1976
Schreurs, P.H.; de Jong, A.J.; Brandsma, L., Recl. Trav. Chim. Pays-Bas, 1976, 95, 75. [all data]

Galesloot, Brandsma, et al., 1969
Galesloot, W.G.; Brandsma, L.; Arens, J.F., Formation of Substituted Furans from Alcohols with A Conjugated Enzyme System, Recl. Trav. Chim. Pays-Bas, 1969, 88, 671. [all data]

Morel and Verkade, 1951
Morel, Th.; Verkade, P.E., A New Method for Synthesis of Furan Derivatives III., Recl. Trav. Chim. Pays-Bas, 1951, 70, 35. [all data]

Hunter and Lias, 1998
Hunter, E.P.; Lias, S.G., Evaluated Gas Phase Basicities and Proton Affinities of Molecules: An Update, J. Phys. Chem. Ref. Data, 1998, 27, 3, 413-656, https://doi.org/10.1063/1.556018 . [all data]

Grutzmacher and Spilker, 1985
Grutzmacher, H.-F.; Spilker, R., Loss of CO from 4,6-dimethyl-2-pyrone and 2,6-dimethyl-4-pyrone radical cations, Org. Mass Spectrom., 1985, 20, 258. [all data]

Notes

Go To: Top, Phase change data, Gas phase ion energetics data, Mass spectrum (electron ionization), References

• Symbols used in this document:
  

  Tboil

  Boiling point

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