Terephthalic acid

• Formula: C₈H₆O₄
• Molecular weight: 166.1308
• IUPAC Standard InChI: InChI=1S/C8H6O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h1-4H,(H,9,10)(H,11,12) Copy

  
• IUPAC Standard InChIKey: KKEYFWRCBNTPAC-UHFFFAOYSA-N Copy
• CAS Registry Number: 100-21-0
• 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: 1,4-Benzenedicarboxylic acid; p-Benzenedicarboxylic acid; p-Dicarboxybenzene; p-Phthalic acid; WR 16262; Benzene, 1,4-dicarboxylic acid; Acide terephtalique; Benzene, p-dicarboxylic acid; TPA; Kyselina tereftalova; TA 12; Ta-33mp; 1,4-Dicarboxybenzene; NSC 36973; p-Carboxybenzoic acid
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• Information on this page:
  • Gas phase ion energetics data
  • References
  • Notes
• Other data available:
  • Condensed phase thermochemistry data
  • Phase change data
  • Mass spectrum (electron ionization)
  • UV/Visible spectrum
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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: Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi

Ionization energy determinations

Appearance energy determinations

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.

Benoit, 1973
Benoit, F., Substituent effects in mass spectrometry. III. Substituent effects in the dissociation of the molecular ions of para and meta subtituted benzoic acids, Org. Mass Spectrom., 1973, 7, 295. [all data]

Notes

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• Symbols used in this document:
  

  AE	Appearance energy

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