Hippuric acid

• Formula: C₉H₉NO₃
• Molecular weight: 179.1727
• IUPAC Standard InChI: InChI=1S/C9H9NO3/c11-8(12)6-10-9(13)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,13)(H,11,12) Copy

  
• IUPAC Standard InChIKey: QIAFMBKCNZACKA-UHFFFAOYSA-N Copy
• CAS Registry Number: 495-69-2
• 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: Glycine, N-benzoyl-; Acetic acid, (benzoylamino)-; Benzamidoacetic acid; Benzoylglycine; N-Benzoylglycine; Phenylcarbonylaminoacetic acid; Acido ippurico; 2-Benzamidoacetic acid; Benzenecarboxamide, N-carboxymethyl-; Benzoylaminoacetic acid; Benzoylglycin; Benzoylglycocoll; NSC 9982
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• Information on this page:
  • Condensed phase thermochemistry data
  • IR Spectrum
  • Mass spectrum (electron ionization)
  • References
  • Notes
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Condensed 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 as indicated in comments:
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DH - Eugene S. Domalski and Elizabeth D. Hearing

Constant pressure heat capacity of solid

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: Coblentz Society, Inc.

Condensed Phase Spectrum

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Notice: Except where noted, spectra from this collection were measured on dispersive instruments, often in carefully selected solvents, and hence may differ in detail from measurements on FTIR instruments or in other chemical environments. More information on the manner in which spectra in this collection were collected can be found here.

Notice: Concentration information is not available for this spectrum and, therefore, molar absorptivity values cannot be derived.

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.

Fairbrother, Skinner, et al., 1957
Fairbrother, D.M.; Skinner, H.A.; Evans, F.W., The heats of combustion of organic compounds of nitrogen, Trans. Faraday Soc., 1957, 53, 779-783. [all data]

Oleinik, Mikina, et al., 1979
Oleinik, B.N.; Mikina, V.D.; Aleksandrov, Yu.I.; Ushcevich, V.F.; Osipova, T.R.; Hrustaleva, K.A., A new determination of the energy of combustion of hippuric acid, J. Chem. Thermodyn., 1979, 11, 145-151. [all data]

Hubbard, Frow, et al., 1961
Hubbard, W.N.; Frow, F.R.; Waddington, G., The heats of combustion and formation of pyridine and hippuric acid, J. Phys. Chem., 1961, 65, 1326-1328. [all data]

Wagner, 1961
Wagner, W., Uber die Verwendung von Thermistoren in der Prazisionskalorimetric Ein neues Metallblock-Verbrennungskalorimeter, Z. Phys. Chem., 1961, 218, 392-416. [all data]

Huffman, 1942
Huffman, H.M., Thermal data. XV. The heats of combustion and free energies of some compounds containing the peptide bond, J. Phys. Chem., 1942, 46, 885-891. [all data]

Huffman, 1941
Huffman, H.M., Thermal data. XIV. The heat capacities and entropies of some compounds having the peptide bond, J. Am. Chem. Soc., 1941, 63, 688-689. [all data]

Notes

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• Symbols used in this document:
  

  Cp,solid	Constant pressure heat capacity of solid
  S°solid,1 bar	Entropy of solid at standard conditions (1 bar)
  ΔcH°liquid	Enthalpy of combustion of liquid at standard conditions
  ΔcH°solid	Enthalpy of combustion of solid at standard conditions
  ΔfH°solid	Enthalpy of formation of solid at standard conditions

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