2,2,4-Trimethyl-3-pentanone

• Formula: C₈H₁₆O
• Molecular weight: 128.2120
• IUPAC Standard InChI: InChI=1S/C8H16O/c1-6(2)7(9)8(3,4)5/h6H,1-5H3 Copy

  
• IUPAC Standard InChIKey: OVCHQRXVZXVQNQ-UHFFFAOYSA-N Copy
• CAS Registry Number: 5857-36-3
• 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: tert-Butyl isopropyl ketone; tert-C4H9CO(iso-C3H7); Isopropyl tert-butyl ketone; Pentamethylacetone; 3-Pentanone, 2,2,4-trimethyl-
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• Information on this page:
  • Normal boiling point
  • References
  • Notes
• Other data available:
  • Gas phase thermochemistry data
  • Condensed phase thermochemistry data
  • Phase change data
  • Gas phase ion energetics data
  • IR Spectrum
  • Mass spectrum (electron ionization)
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Normal boiling point

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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: Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director

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.

Foley, Welch, et al., 1960
Foley, W.M.; Welch, F.J.; Lacombe, E.M.; Mosher, H.S., J. Am. Chem. Soc., 1960, 81, 2779-81. [all data]

Petrov, Sokolova, et al., 1960
Petrov, A.D.; Sokolova, E.B.; Kao, C.L., Reaction of tert-Butyllithium with Esters of Acids, Zh. Obshch. Khim., 1960, 30, 1107. [all data]

Cook, 1952
Cook, N.C., , Unpublished, Final Rep. Stand. Proj. on Oxygenated Compounds, Penn. State Univ., College Park, PA, 1952. [all data]

Howard, Mears, et al., 1947
Howard, F.L.; Mears, T.W.; Fookson, A.; Pomerantz, P.; Brooks, D.B., Preparation and physical properties of several aliphatic hydrocarbons and intermediates, J. Res. Natl. Bur. Stand. (U. S.), 1947, 38, 365. [all data]

Nazarov, 1936
Nazarov, I.N., Chem. Ber., 1936, 69, 21. [all data]

Pfeiffer and Adkins, 1931
Pfeiffer, G.J.; Adkins, H., The Relation of the Structure of Ketones to Their Reactivity and Affinity in Acetal Formation II., J. Am. Chem. Soc., 1931, 53, 1043. [all data]

Henderson, Henderson, et al., 1914
Henderson, G.G.; Henderson, J.A.R.; Heilbron, I.M., Chem. Ber., 1914, 47, 876. [all data]

Favorskii, 1913
Favorskii, A., J. Prakt. Chem., 1913, 88, 641. [all data]

Haller and Bauer, 1913
Haller, A.; Bauer, E., Ann. Chim. (Paris), 1913, 29, 8, 313. [all data]

Notes

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• Symbols used in this document:
  

  Tboil

  Boiling point

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