Cyanuric acid

• Formula: C₃H₃N₃O₃
• Molecular weight: 129.0742
• IUPAC Standard InChI: InChI=1S/C3H3N3O3/c7-1-4-2(8)6-3(9)5-1/h(H3,4,5,6,7,8,9) Copy

  
• IUPAC Standard InChIKey: ZFSLODLOARCGLH-UHFFFAOYSA-N Copy
• CAS Registry Number: 108-80-5
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
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• Species with the same structure:
  • Cyanuric acid
• Other names: 1,3,5-Triazine-2,4,6(1H,3H,5H)-trione; s-Triazine-2,4,6(1H,3H,5H)-trione; s-Triazine-2,4,6-triol; s-Triazinetriol; Isocyanuric acid; Pseudocyanuric acid; Tricyanic acid; Trihydroxycyanidine; 2,4,6-Trihydroxy-1,3,5-triazine; 1,3,5-Triazine-2,4,6-triol; s-2,4,6-Triazinetriol; sym-Triazinetriol; Kyselina kyanurova; 2,4,6-Trihydroxytriazine; 2,4,6-Trihydroxy-S-triazine; 2,4,6-Trioxohexahydro-1,3,5-triazine; 5-Azabarbituric acid; 2,4,6-Triazinetrione; Isocyanurate acid; s-Triazine-2,4,6-trione; s-Triazinetrione; Tricarbimide; NSC 6284
• Information on this page:
  • Gas phase thermochemistry data
  • Condensed phase thermochemistry data
  • Phase change data
  • IR Spectrum
  • Mass spectrum (electron ionization)
  • UV/Visible spectrum
  • References
  • Notes
• Data at other public NIST sites:
  • Gas Phase Kinetics Database
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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

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

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:
AC - William E. Acree, Jr., James S. Chickos
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Enthalpy of sublimation

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

UV/Visible 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: Victor Talrose, Alexander N. Yermakov, Alexy A. Usov, Antonina A. Goncharova, Axlexander N. Leskin, Natalia A. Messineva, Natalia V. Trusova, Margarita V. Efimkina

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.

Kozyro, Kabo, et al., 1992
Kozyro, A.A.; Kabo, G.Ya.; Soldatova, T.V.; Simirskii, V.V.; Gogolinskii, V.I.; Krasulin, A.P.; Dudarevich, N.M., Thermodynamic properties of cyanuric acid, Russ. J. Phys. Chem. (Engl. Transl.), 1992, 66, 1374-1377. [all data]

Selivanov, Karlik, et al., 1973
Selivanov, V.D.; Karlik, V.M.; Zagranicnyi, V.I., Standard enthalpies of formation ammeline, ammelide, melem, and melon, Russ. J. Phys. Chem. (Engl. Transl.), 1973, 47, 272. [all data]

Kozyro, Kabo, et al., 1992, 2
Kozyro, A.A.; Kabo, G.Ya.; Soldatova, T.V.; Simirskii, V.V.; Gogolinskii, V.I.; Krasulin, A.P.; Dudarevich, N.M., Thermodynamic properties of cyanuric acid, Zhur. Fiz. Khim., 1992, 66(10), 2583-2590. [all data]

DeWit, DeKruif, et al., 1983
DeWit, H.G.M.; DeKruif, C.G.; Van Miltenburg, J.C., Thermodynamic properties of molecular organic crystals containing organic crystals containing nitrogen, oxygen, and sulfur. II. Molar heat capacities of eight compounds by adiabatic calorimetry, J. Chem. Thermodynam., 1983, 15, 891-902. [all data]

De Wit, Van Miltenburg, et al., 1983
De Wit, H.G.M.; Van Miltenburg, J.C.; De Kruif, C.G., Thermodynamic properties of molecular organic crystals containing nitrogen, oxygen, and sulphur 1. Vapour pressures and enthalpies of sublimation, The Journal of Chemical Thermodynamics, 1983, 15, 7, 651-663, https://doi.org/10.1016/0021-9614(83)90079-4 . [all data]

Johnson, 1966
Johnson, E.A., UV atlas of organic compounds, 1966, 1, B11/9. [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°solid	Enthalpy of combustion of solid at standard conditions
  ΔfH°gas	Enthalpy of formation of gas at standard conditions
  ΔfH°solid	Enthalpy of formation of solid at standard conditions
  ΔsubH	Enthalpy of sublimation
  ΔsubH°	Enthalpy of sublimation at standard conditions

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