3,4,5-Trihydroxybenzoic acid hydrate (1:1)

CAS Registry Number®

5995-86-8
No image available.

CAS Name

3,4,5-Trihydroxybenzoic acid hydrate (1:1)

Molecular Formula

C7H6O5.H2O

Cite this Page

3,4,5-Trihydroxybenzoic acid hydrate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=5995-86-8 (retrieved 2022-12-04) (CAS RN: 5995-86-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    258-260 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H6O5.H2O/c8-4-1-3(7(11)12)2-5(9)6(4)10;/h1-2,8-10H,(H,11,12);1H2

InChIKey

InChIKey=IUTKPPDDLYYMBE-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=CC(O)=C(O)C(O)=C1.O

Canonical SMILES

O=C(O)C1=CC(O)=C(O)C(O)=C1.O

Other Names for this Substance

  • Benzoic acid, 3,4,5-trihydroxy-, hydrate (1:1)
  • Gallic acid, monohydrate
  • Benzoic acid, 3,4,5-trihydroxy-, monohydrate
  • 3,4,5-Trihydroxybenzoic acid hydrate (1:1)