Phenol, 2-(1,1-dimethylethyl)-4-methyl-

• Formula: C₁₁H₁₆O
• Molecular weight: 164.2441
• IUPAC Standard InChI: InChI=1S/C11H16O/c1-8-5-6-10(12)9(7-8)11(2,3)4/h5-7,12H,1-4H3 Copy

  
• IUPAC Standard InChIKey: IKEHOXWJQXIQAG-UHFFFAOYSA-N Copy
• CAS Registry Number: 2409-55-4
• 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: p-Cresol, 2-tert-butyl-; o-tert-Butyl-p-cresol; 2-tert-Butyl-p-Cresol; 2-tert-Butyl-4-Methylphenol; 4-Methyl-2-tert-butylphenol; 1-Hydroxy-2-tert-butyl-4-methylbenzene; 2-tert-Butyl-4-methyl-1-phenol; 2-Terc.butyl-p-kresol; 2-t-Butyl-p-cresol; 2-t-Butyl-4-methylphenol; 2-(1,1-Dimethylethyl)-4-methyl-phenol; 2-tert-Butyl-4-cresol; 4-Methyl-2-(1,1-dimethylethyl)phenol; 4-Methyl-6-t-butylphenol; NSC 60301; 2-(1,1'-dimethylethyl)-4-methylphenol
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• Information on this page:
  • Gas Chromatography
  • References
  • Notes
• Other data available:
  • Gas phase thermochemistry data
  • Phase change data
  • Reaction thermochemistry data
  • IR Spectrum
  • Mass spectrum (electron ionization)
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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

Kovats' RI, non-polar column, isothermal

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Van Den Dool and Kratz RI, non-polar column, temperature ramp

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Van Den Dool and Kratz RI, non-polar column, custom temperature program

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Van Den Dool and Kratz RI, polar column, temperature ramp

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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.

Verevkin, Nesterov, et al., 1990
Verevkin, S.P.; Nesterov, O.A.; Rempel, P.D.; Synkova, N.V.; Shashkin, N.P., Chromatographic determination of the products of condensation of alkylphenols with formic aldehyde, Zh. Anal. Khim., 1990, 43, 760-761. [all data]

Aaslyng, Elmore, et al., 1998
Aaslyng, M.D.; Elmore, J.S.; Mottram, D.S., Comparison of the aroma characteristics of acid-hydrolyzed and enzyme-hydrolyzed vegetable proteins produced from soy, J. Agric. Food Chem., 1998, 46, 12, 5225-5231, https://doi.org/10.1021/jf9806816 . [all data]

Mjøs, Meier, et al., 2006
Mjøs, S.A.; Meier, S.; Boitsov, S., Alkylphenol retention indices, J. Chromatogr. A, 2006, 1123, 1, 98-105, https://doi.org/10.1016/j.chroma.2006.05.002 . [all data]

Chung, 1999
Chung, H.Y., Volatile components in crabmeats of Charybdis feriatus, J. Agric. Food Chem., 1999, 47, 6, 2280-2287, https://doi.org/10.1021/jf981027t . [all data]

Notes

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