4-n-Propylbenzoic acid

• Formula: C₁₀H₁₂O₂
• Molecular weight: 164.2011
• IUPAC Standard InChI: InChI=1S/C10H12O2/c1-2-3-8-4-6-9(7-5-8)10(11)12/h4-7H,2-3H2,1H3,(H,11,12) Copy

  
• IUPAC Standard InChIKey: ATZHGRNFEFVDDJ-UHFFFAOYSA-N Copy
• CAS Registry Number: 2438-05-3
• 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-n-Propyl benzoic acid; Benzoic acid, 4-propyl-; 4-Propylbenzoic acid
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• Information on this page:
  • Phase change data
  • IR Spectrum
  • Mass spectrum (electron ionization)
  • References
  • Notes
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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

Enthalpy of fusion

IR Spectrum

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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

Gas Phase Spectrum

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Additional Data

Mass spectrum (electron ionization)

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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

Spectrum

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Additional Data

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.

Privalko, Puchkovskaya, et al., 1985
Privalko, V.P.; Puchkovskaya, G.A.; Shermatov, E.N.; Yakubov, A.A., Polymorphic Transitions in Alkylbenzoic Acids, Mol. Cryst. Liq. Cryst., 1985, 126, 2-4, 289, https://doi.org/10.1080/00268948508084797 . [all data]

Monte, Almeida, et al., 2004
Monte, Manuel J.S.; Almeida, Ana R.R.P.; Ribeiro da Silva, Manuel A.V., Thermodynamic study of the sublimation of eight 4-n-alkylbenzoic acids, The Journal of Chemical Thermodynamics, 2004, 36, 5, 385-392, https://doi.org/10.1016/j.jct.2004.02.001 . [all data]

Privalko, Puchkovskaya, et al., 1985, 2
Privalko, V.P.; Puchkovskaya, G.A.; Shermatov, E.N.; Yakubov, A.A., Polymorphic Transitions in Alkylbenzoic Acids, Molecular Crystals and Liquid Crystals, 1985, 126, 2-4, 289-297, https://doi.org/10.1080/00268948508084797 . [all data]

Notes

Go To: Top, Phase change data, IR Spectrum, Mass spectrum (electron ionization), References

• Symbols used in this document:
  

  Tfus	Fusion (melting) point
  ΔfusH	Enthalpy of fusion
  ΔsubH°	Enthalpy of sublimation at standard conditions

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