1-Hexanol, 4-methyl- - The NIST WebBook

1-Hexanol, 4-methyl-

• Formula: C7H16O
• Molecular weight: 116.2013
• IUPAC Standard InChI: InChI=1S/C7H16O/c1-3-7(2)5-4-6-8/h7-8H,3-6H2,1-2H3 Copy
• IUPAC Standard InChIKey: YNPVNLWKVZZBTM-UHFFFAOYSA-N Copy
• CAS Registry Number: 818-49-5
• Chemical structure: This structure is also available as a 2d Mol file or as a computed 3d SD file View 3d structure (requires JavaScript / HTML 5)
• Stereoisomers:
  • 1-Hexanol, 4-methyl-, (S)-
• Other names: 4-Methylhexanol; 4-Methyl-1-hexanol; 4-Methylhexan-1-ol
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• Information on this page:
  • Phase change data
  • References
  • Notes
• Other data available:
  • Mass spectrum (electron ionization)
  • 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: TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director AC - William E. Acree, Jr., James S. Chickos

Quantity	Value	Units	Method	Reference	Comment
Tboil	446.15	K	N/A	Pichler, Ziesecke, et al., 1950	Uncertainty assigned by TRC = 1. K; TRC
Tboil	436.15	K	N/A	Graves, 1931	Uncertainty assigned by TRC = 2. K; TRC

Enthalpy of vaporization

ΔvapH (kJ/mol)	Temperature (K)	Reference	Comment
62.6	363.	Wilhoit and Zwolinski, 1973	Based on data from 348. to 448. K.; AC

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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.

Pichler, Ziesecke, et al., 1950 Pichler, H.; Ziesecke, K.H.; Traeger, B., The Oxygen-containing Compounds, Especially Alcohols, Formed in Isosynthesis, Brennst.-Chem., 1950, 31, 361. [all data]

Graves, 1931 Graves, G.D., Ind. Eng. Chem., 1931, 23, 1381. [all data]

Wilhoit and Zwolinski, 1973 Wilhoit, R.C.; Zwolinski, B.J., Physical and thermodynamic properties of aliphatic alcohols, J. Phys. Chem. Ref. Data Suppl., 1973, 1, 2, 1. [all data]

Notes

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• Symbols used in this document:

  Tboil	Boiling point
  ΔvapH	Enthalpy of vaporization

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