Propyl gallate

• Formula: C₁₀H₁₂O₅
• Molecular weight: 212.1993
• IUPAC Standard InChI: InChI=1S/C10H12O5/c1-2-3-15-10(14)6-4-7(11)9(13)8(12)5-6/h4-5,11-13H,2-3H2,1H3 Copy

  
• IUPAC Standard InChIKey: ZTHYODDOHIVTJV-UHFFFAOYSA-N Copy
• CAS Registry Number: 121-79-9
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
  The 3d structure may be viewed using Java or Javascript.
• Other names: Benzoic acid, 3,4,5-trihydroxy-, propyl ester; Gallic acid, propyl ester; n-Propyl gallate; n-Propyl 3,4,5-trihydroxybenzoate; Nipa 49; Nipagallin P; Progallin P; Propyl 3,4,5-trihydroxybenzoate; Tenox PG; Gallic acid n-propyl ester; n-Propyl ester of 3,4,5-trihydroxybenzoic acid; NCI-C505888; 3,4,5-Trihydroxybenzene-1-propylcarboxylate; 3,4,5-Trihydroxybenzoic acid, propyl ester; Propylester kyseliny gallove; 3,4,5-Trihydroxybenzoic acid n-propyl ester; PG; NSC 2626
• Permanent link for this species. Use this link for bookmarking this species for future reference.
• Information on this page:
  • Reaction thermochemistry data
  • IR Spectrum
  • References
  • Notes
• Other data available:
  • Mass spectrum (electron ionization)
• Options:
  • Switch to calorie-based units

Reaction thermochemistry data

Go To: Top, IR Spectrum, References, Notes

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

Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.

Individual Reactions

 +  =  + 

By formula: C₁₀H₁₂O₅ + H₂O = C₇H₆O₅ + C₃H₈O

IR Spectrum

Go To: Top, Reaction thermochemistry data, References, Notes

Data compiled by: Coblentz Society, Inc.

• SOLID (KBr PELLET); PERKIN-ELMER; DIGITIZED BY NIST FROM HARD COPY; 4 cm^-1 resolution
• SOLID (OIL MULL); BAIRD NaCl PRISM; DIGITIZED BY NIST FROM HARD COPY; 4 cm^-1 resolution

References

Go To: Top, Reaction thermochemistry data, IR Spectrum, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Tewari, Schantz, et al., 1996
Tewari, Y.B.; Schantz, M.M.; Rekharsky, M.V.; Goldberg, R.N., Thermodynamics of the hydrolysis of 3,4,5-trihydroxybenzoic acid propyl ester (n-propylgallate) to 3,4,5-trihydroxybenzoic acid (gallic acid) and propan-1-ol in aqueous media and in toluene, J. Chem. Thermodyn., 1996, 28, 171-185. [all data]

Notes

Go To: Top, Reaction thermochemistry data, IR Spectrum, References

• Symbols used in this document:
  

  ΔrH°	Enthalpy of reaction at standard conditions

• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
• The National Institute of Standards and Technology (NIST) uses its best efforts to deliver a high quality copy of the Database and to verify that the data contained therein have been selected on the basis of sound scientific judgment. However, NIST makes no warranties to that effect, and NIST shall not be liable for any damage that may result from errors or omissions in the Database.
• Customer support for NIST Standard Reference Data products.