Benzoic acid, 2-(1-methylethyl)-

• Formula: C₁₀H₁₂O₂
• Molecular weight: 164.2011
• IUPAC Standard InChI: InChI=1S/C10H12O2/c1-7(2)8-5-3-4-6-9(8)10(11)12/h3-7H,1-2H3,(H,11,12) Copy

  
• IUPAC Standard InChIKey: BANZVKGLDQDFDV-UHFFFAOYSA-N Copy
• CAS Registry Number: 2438-04-2
• Chemical structure:
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• Information on this page:
  • Gas phase thermochemistry data
  • Gas phase ion energetics data
  • References
  • Notes
• Other data available:
  • Condensed phase thermochemistry data
  • Phase change data
  • Reaction thermochemistry data
  • Mass spectrum (electron ionization)
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Gas phase thermochemistry 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: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

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: John E. Bartmess

De-protonation reactions

C₁₀H₁₁O₂^- +  =

By formula: C₁₀H₁₁O₂^- + H⁺ = C₁₀H₁₂O₂

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.

Colomina, Jimenez, et al., 1987
Colomina, M.; Jimenez, P.; Perez-Ossorio, R.; Roux, M.V.; Turrion, C., Thermochemical properties of benzoic acid derivatives. XIV. Enthalpies of combustion, vapour pressures, enthalpies of sublimation, and enthalpies of formation of o-, m-, and p-isopropylbenzoic acids, J. Chem. Thermodyn., 1987, 19, 155-162. [all data]

Fiedler, Kulhanek, et al., 1999
Fiedler, P.; Kulhanek, J.; Decouzon, M.; Gal, J.F.; Maria, P.C.; Exner, O., Steric effects and steric inhibition of resonance in isopropylbenzoic acids in the gas phase and in solution, Coll. Czech. Chem. Commun., 1999, 64, 9, 1433-1447, https://doi.org/10.1135/cccc19991433 . [all data]

Notes

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

• Symbols used in this document:
  

  ΔfH°gas	Enthalpy of formation of gas at standard conditions
  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
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