3-Butyn-2-ol, 2-methyl-

• Formula: C₅H₈O
• Molecular weight: 84.1164
• IUPAC Standard InChI: InChI=1S/C5H8O/c1-4-5(2,3)6/h1,6H,2-3H3 Copy

  
• IUPAC Standard InChIKey: CEBKHWWANWSNTI-UHFFFAOYSA-N Copy
• CAS Registry Number: 115-19-5
• 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: α,α-Dimethylpropargyl alcohol; Dimethylacetylenecarbinol; Dimethylacetylenylcarbinol; Dimethylethynylcarbinol; Dimethylethynylmethanol; Ethynyldimethylcarbinol; 1,1-Dimethyl-2-propynol; 1,1-Dimethylpropargyl alcohol; 2-Methyl-2-butynol; 2-Methyl-3-butyn-2-ol; 3-Methyl-1-butyn-3-ol; 3-Hydroxy-3-methyl-1-butyne; Carbavane; 3-Methylbutynol; 1-Butyn-3-ol, 3-methyl-; 1,1-Dimethylpropynol; 2-Hydroxy-2-methyl-3-butyne; 3-Methyl-butin-(1)-ol-(3); 2-Methylbutyn-3-ol-2; NSC 523; 2-methylbut-3-yn-2-ol
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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:
  • IR Spectrum
  • Gas Chromatography
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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

Antoine Equation Parameters

log₁₀(P) = A − (B / (T + C))
    P = vapor pressure (bar)
    T = temperature (K)

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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 by: Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi

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.

Farchan Laboratories, 1990
Farchan Laboratories, Research Chemicals Catalog, Farchan Laboratories, Gainesville, FL, 1990, 91. [all data]

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]

Henne and Greenlee, 1945
Henne, A.L.; Greenlee, K.W., Preparation and Physical Constants of Acetylenic Compounds, J. Am. Chem. Soc., 1945, 67, 484-5. [all data]

Campbell and Eby, 1941
Campbell, K.N.; Eby, L.T., The Reduction of Multiple Carbon-Carbon Bonds III. Further Studies on the Preparation of Olefins from Acetylenes, J. Am. Chem. Soc., 1941, 63, 2683. [all data]

Zaretskii, Chartov, et al., 1999
Zaretskii, M.I.; Chartov, E.M.; Pushkina, L.A.; Elkin, V.V., Liquid-vapor phase equilibria in systems formed by C5 and C10 tertiary acetylenic alcohols with dimethyl sulfoxide and N-Methylpyrrolidone, Zh. Prikl. Khim., 1999, 72, 10, 1612. [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]

Dykyj, 1972
Dykyj, J., Petrochemia, 1972, 12, 1, 13. [all data]

Boublik, Fried, et al., 1984
Boublik, T.; Fried, V.; Hala, E., The Vapour Pressures of Pure Substances: Selected Values of the Temperature Dependence of the Vapour Pressures of Some Pure Substances in the Normal and Low Pressure Region, 2nd ed., Elsevier, New York, 1984, 972. [all data]

Conner, Elving, et al., 1950
Conner, Albert Z.; Elving, Philip J.; Benischeck, Joseph; Tobias, Philip E.; Steingiser, Samuel, Vapor-Liquid Equilibria in Binary Systems -Water-2-Methyl-3-butyn-2-ol and Water-3-Hydroxy-3-methyl-butanone, Ind. Eng. Chem., 1950, 42, 1, 106-110, https://doi.org/10.1021/ie50481a030 . [all data]

Andreocci, Bitchev, et al., 1979
Andreocci, M.V.; Bitchev, P.; Carusi, P.; Furlani, A., Valence shell photoionization spectra of some substituted hydroxy-acetylenes. A tentative correlation with their cyclotrimerization reactions, J. Electron Spectrosc. Relat. Phenom., 1979, 16, 25. [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
  Tfus	Fusion (melting) point
  ΔvapH	Enthalpy of vaporization

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