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Key Documents

242381

Sigma-Aldrich

Benzoic acid

ACS reagent, ≥99.5%

Sinônimo(s):

Benzenecarboxylic acid, Carboxybenzene

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About This Item

Fórmula linear:
C6H5COOH
Número CAS:
Peso molecular:
122.12
Beilstein:
636131
Número CE:
Número MDL:
Código UNSPSC:
12352100
eCl@ss:
39023903
ID de substância PubChem:
NACRES:
NA.21

grau

ACS reagent

Nível de qualidade

densidade de vapor

4.21 (vs air)

pressão de vapor

10 mmHg ( 132 °C)

Ensaio

≥99.5%

forma

crystalline

temperatura de autoignição

1061 °F

embalagem

poly bottle of 25, 100, 500 g
poly drum of 3 kg

Impurezas

MnO4- reducers, passes test
≤0.002% S compounds
≤0.005% CH3OH insol.

resíduo de ignição

≤0.005%

pb

249 °C (lit.)

pf

121-125 °C (lit.)

solubilidade

water: soluble (2.9 g/l at 25 °C)

traços de ânion

chloride (Cl-): ≤0.005%

traços de cátion

heavy metals (as Pb): ≤5 ppm

cadeia de caracteres SMILES

OC(=O)c1ccccc1

InChI

1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)

chave InChI

WPYMKLBDIGXBTP-UHFFFAOYSA-N

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Descrição geral

Benzoic acid is an organic aromatic monocarboxylic acid. It can be synthesized by the cobalt or manganese catalyzed atmospheric oxidation of toluene. Recently, benzoic acid has been prepared from toluene by employing TiO2 nanotubes electrode.
Benzoic acid reacts with hydrogenating reagents to afford hexahydrobenzoic acid. The thermal decomposition of the product in the presence of lime or alkali produces benzene and carbon dioxide.

Aplicação

Benzoic acid has been used in the preparation of vials for the HPLC analysis of various polyamines in biological fluids, tissues and isolated/cultured cells.
It may be employed as an intermediate in the synthesis of the following:
  • paints
  • pigments
  • varnish
  • wetting agents
  • aroma compounds
  • benzoyl chloride
  • benzotrichloride
It may also be used to investigate the mechanism of complex addition reaction of hydroxyl radicals with various aromatic compounds.

Pictogramas

Health hazardCorrosion

Palavra indicadora

Danger

Frases de perigo

Classificações de perigo

Eye Dam. 1 - Skin Irrit. 2 - STOT RE 1 Inhalation

Órgãos-alvo

Lungs

Código de classe de armazenamento

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

Classe de risco de água (WGK)

WGK 1

Ponto de fulgor (°F)

Not applicable

Ponto de fulgor (°C)

Not applicable


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Supelco

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Benzoic acid

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Sigma-Aldrich

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Benzoic acid volumetric standard, secondary reference material for alkalimetry, traceable to NIST Standard Reference Material (SRM) Certipur® Reag. Ph Eur,Reag. USP

Supelco

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Benzoic acid

Zhaolai Dai et al.
Amino acids, 46(6), 1557-1564 (2014-03-19)
Polyamines (putrescine, spermine and spermidine) play a crucial role in the regulation of cell growth, differentiation, death and function. Accurate measurement of these substances is essential for studying their metabolism in cells. This protocol describes detailed procedures for sample preparation
Hydroxylation by electrochemically generated OH. radicals. Mono-and polyhydroxylation of benzoic acid: products and isomer distribution.
Oturan MA and Pinson J.
The Journal of Physical Chemistry, 99(38), 13948-13954 (1995)
Eagleson M.
Concise Encyclopedia Chemistry, 122-122 (1994)
Shutang Tan et al.
Cell reports, 33(9), 108463-108463 (2020-12-03)
The widely used non-steroidal anti-inflammatory drugs (NSAIDs) are derivatives of the phytohormone salicylic acid (SA). SA is well known to regulate plant immunity and development, whereas there have been few reports focusing on the effects of NSAIDs in plants. Our
G C Tremblay et al.
Pharmacology & therapeutics, 60(1), 63-90 (1993-10-01)
Detoxification of sodium benzoate by elimination as a conjugate with glycine, a nonessential amino acid, provides a pathway for the disposal of waste nitrogen. Since 1979, sodium benzoate has been widely used in the therapeutic regimen to combat ammonia toxicity

Protocolos

Separation of 4-Hydroxybenzoic acid; Acetylsalicylic acid; Benzoic acid; Salicylic acid; Ethyl 4-hydroxybenzoate

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