(E)-1,3-Butadien-1-ol

• Formula: C₄H₆O
• Molecular weight: 70.0898
• IUPAC Standard InChI: InChI=1S/C4H6O/c1-2-3-4-5/h2-5H,1H2/b4-3+ Copy

  
• IUPAC Standard InChIKey: LNDKRVOOYMEYTC-ONEGZZNKSA-N Copy
• CAS Registry Number: 70411-98-2
• Chemical structure:
  This structure is also available as a 2d Mol file
• Stereoisomers:
  • (Z)-1,3-Butadien-1-ol
• Other names: CH2=CHCH=CHOH (E)-; (E)-1-Hydroxy-1,3-butadiene; (1E)-1,3-Butadien-1-ol; (E)-1,3-Butadienol
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• Information on this page:
  • Gas phase thermochemistry data
  • Gas phase ion energetics data
  • References
  • Notes
• Other data available:
  • Mass spectrum (electron ionization)
• Options:
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Gas phase 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

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:
LBLHLM - Sharon G. Lias, John E. Bartmess, Joel F. Liebman, John L. Holmes, Rhoda D. Levin, and W. Gary Mallard

View reactions leading to C₄H₆O⁺ (ion structure unspecified)

Ionization energy determinations

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.

Turecek, Havlas, et al., 1986
Turecek, F.; Havlas, Z.; Maquin, F.; Hill, N.; Gaumann, T., (E)- And (Z)-1-hydroxy-1,3-butadiene: new kinetically unstable C₄H₆O, J. Org. Chem., 1986, 51, 4061-4065. [all data]

Turecek, Havlas, et al., 1986, 2
Turecek, F.; Havlas, Z.; Maquin, F.; Hill, N.; Gaumann, T., (E)- and (Z)-1-hydroxy-1,3-butadiene: New kinetically unstable C₄H₆O isomers, J. Org. Chem., 1986, 51, 4061. [all data]

Notes

Go To: Top, Gas phase thermochemistry data, Gas phase ion energetics data, References

• Symbols used in this document:
  

  ΔfH°gas

  Enthalpy of formation of gas at standard conditions

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