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398225

Sigma-Aldrich

Gallic acid monohydrate

ACS reagent, ≥98.0%

Synonym(s):

3,4,5-Trihydroxybenzoic acid monohydrate

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About This Item

Linear Formula:
(HO)3C6H2CO2H · H2O
CAS Number:
Molecular Weight:
188.13
Beilstein:
2050274
EC Number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.21

grade

ACS reagent

Quality Level

Assay

≥98.0%

form

powder

impurities

≤0.01% insolubles

ign. residue

≤0.005%

mp

252 °C (dec.) (lit.)

anion traces

sulfate (SO42-): ≤0.02%

SMILES string

OC(=O)c1cc(O)c(O)c(O)c1

InChI

1S/C7H6O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,8-10H,(H,11,12)/p-1

InChI key

LNTHITQWFMADLM-UHFFFAOYSA-M

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General description

Gallic acid monohydrate is a phenolic acid. A study of its crystalline structure reveals that it is planar with two intramolecular hydrogen bonds and five intermolecular hydrogen bonds. Gallic acid is of significant importance because of its antioxidant and anti-cancer activities. Infrared and Raman spectral studies of gallic acid have been reported.

Application

Gallic acid monohydrate may be used as a standard in the photometric determination of total phenolics content by Folin-Ciocalteu method.

Storage Class Code

11 - Combustible Solids

WGK

WGK 2

Flash Point(F)

482.0 °F - closed cup

Flash Point(C)

250 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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A third monoclinic polymorph of 3, 4, 5-trihydroxybenzoic acid monohydrate.
Demirtas G, et al.
Acta Crystallographica Section E, Structure Reports Online, 67(6), o1509-o1510 (2011)
Ulyana Muñoz Acuña et al.
Journal of natural products, 73(11), 1775-1779 (2010-10-30)
Two new polyisoprenylated benzophenones, 32-hydroxy-ent-guttiferone M (1) and 6-epi-guttiferone J (2), along with seven known compounds, 6-epi-clusianone (3), guttiferone A (4), xanthochymol (5), guttiferone E (6), isoxanthochymol (7), (+)-volkensiflavone (8), and (+)-morelloflavone (9), were identified from the seeds and rinds

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