Benzenemethanol, α-methyl-

• Formula: C₈H₁₀O
• Molecular weight: 122.1644
• IUPAC Standard InChI: InChI=1S/C8H10O/c1-7(9)8-5-3-2-4-6-8/h2-7,9H,1H3 Copy

  
• IUPAC Standard InChIKey: WAPNOHKVXSQRPX-UHFFFAOYSA-N Copy
• CAS Registry Number: 98-85-1
• 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.
• Stereoisomers:
  • Benzenemethanol, α-methyl-, (S)-
  • Benzenemethanol, α-methyl-, (R)-
• Other names: Benzyl alcohol, α-methyl-; α-Methylbenzyl alcohol; α-Phenethyl alcohol; α-Phenylethanol; α-Phenylethyl alcohol; (1-Hydroxyethyl)benzene; Ethanol, 1-phenyl-; Methylphenylcarbinol; Phenylmethylcarbinol; Styralyl alcohol; 1-Phenethyl alcohol; 1-Phenyl-1-hydroxyethane; 1-Phenylethanol; 1-Phenylethyl alcohol; sec-Phenethyl alcohol; dl-α-Methylbenzyl alcohol; Methanol, methylphenyl-; NCI-C55685; 1-Fenylethanol; Fenyl-methylkarbinol; Styrallyl alcohol; UN 2937; α-Methylbenzenemethanol; α-Hydroxyethylbenzene; NSC 25502; (S)-α-Methyl-benzenemethanol; alcohol methyl benzylic
• Permanent link for this species. Use this link for bookmarking this species for future reference.
• Information on this page:
  • Gas phase ion energetics data
  • References
  • Notes
• Other data available:
  • Phase change data
  • Reaction thermochemistry data
  • IR Spectrum
  • Mass spectrum (electron ionization)
  • Gas Chromatography
• Options:
  • Switch to SI units

Data at NIST subscription sites:

• NIST / TRC Web Thermo Tables, professional edition (thermophysical and thermochemical data)

NIST subscription sites provide data under the NIST Standard Reference Data Program, but require an annual fee to access. The purpose of the fee is to recover costs associated with the development of data collections included in such sites. Your institution may already be a subscriber. Follow the links above to find out more about the data in these sites and their terms of usage.

Gas phase ion energetics data

Go To: Top, References, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: John E. Bartmess

View reactions leading to C₈H₁₀O⁺ (ion structure unspecified)

De-protonation reactions

C₈H₉O^- +  =

By formula: C₈H₉O^- + H⁺ = C₈H₁₀O

References

Go To: Top, Gas phase ion energetics data, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Abboud, Koppel, et al., 2013
Abboud, J.L.M.; Koppel, I.A.; Koppel, I., Additivity of substituent effects on the acidity of alcohols, J. Phys. Org. Chem., 2013, 26, 6, 467-472, https://doi.org/10.1002/poc.3110 . [all data]

Graul, Schnute, et al., 1990
Graul, S.T.; Schnute, M.E.; Squires, R.R., Gas-Phase Acidities of Carboxylic Acids and Alcohols from Collision-Induced Dissociation of Dimer Cluster Ions, Int. J. Mass Spectrom. Ion Proc., 1990, 96, 2, 181, https://doi.org/10.1016/0168-1176(90)87028-F . [all data]

Notes

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

• Symbols used in this document:
  

  ΔrG°	Free energy of reaction at standard conditions
  ΔrH°	Enthalpy of reaction at standard conditions

• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
• The National Institute of Standards and Technology (NIST) uses its best efforts to deliver a high quality copy of the Database and to verify that the data contained therein have been selected on the basis of sound scientific judgment. However, NIST makes no warranties to that effect, and NIST shall not be liable for any damage that may result from errors or omissions in the Database.
• Customer support for NIST Standard Reference Data products.