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Merck

18106

Benzoato de sodio

99.0-100.5% (calc. to the dried substance), powder, puriss., meets analytical specification of Ph. Eur., BP, FCC, E211

Sinónimos:

Ácido benzoico sodium salt

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Fórmula lineal:
C6H5COONa
Número CAS:
Peso molecular:
144.10
NACRES:
NA.21
PubChem Substance ID:
eCl@ss:
39024301
UNSPSC Code:
12352100
EC Number:
208-534-8
MDL number:
Beilstein/REAXYS Number:
3572467
Assay:
99.0-100.5% (calc. to the dried substance)
Form:
powder
Solubility:
water: soluble 556 g/L
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Nombre del producto

Benzoato de sodio, puriss., meets analytical specification of Ph. Eur., BP, FCC, E211, 99.0-100.5% (calc. to the dried substance), powder

grade

puriss.

Quality Level

assay

99.0-100.5% (calc. to the dried substance)

form

powder

quality

meets analytical specification of Ph. Eur., BP, FCC, E211

impurities

acidity or alkalinity, complies, oxidizable impurities, complies, residual solvents, complies, ≤0.001% heavy metals (as Pb), ≤0.03% halogenated compounds (as Cl)

loss

≤1% loss on drying, 105 °C

mp

>300 °C (lit.)

solubility

water: soluble 556 g/L

anion traces

chloride (Cl-): ≤100 mg/kg, sulfate (SO42-): ≤100 mg/kg

cation traces

As: ≤2 mg/kg, Cu: ≤10 mg/kg, Hg: ≤1 mg/kg, Pb: ≤2 mg/kg, Zn: ≤10 mg/kg

suitability

complies for appearance of solution

functional group

phenyl

SMILES string

[Na+].[O-]C(=O)c1ccccc1

InChI

1S/C7H6O2.Na/c8-7(9)6-4-2-1-3-5-6;/h1-5H,(H,8,9);/q;+1/p-1

InChI key

WXMKPNITSTVMEF-UHFFFAOYSA-M

Application

Sodium benzoate can be used as areactant to synthesize:
  • 2-Phenoxyethyl benzoate via phase-transfercatalyzed esterification with 2-phenoxyethyl bromide.
  • Ynones by Pd free coupling reactionwith terminal alkynes in the presence of cyanuric chloride and magnesiumchloride.
It can also be used as a catalyst to synthesize:
  • 3-Methyl-4-arylmethylene-isoxazol-5(4H)-onesby reacting ethyl acetoacetate, hydroxylamine hydrochloride, and aromaticaldehydes.
  • 4-Pyrazolylmethylene-3-phenylisoxazol-5(4H)-onesvia three-component cyclocondensation of pyrazole-4-carbaxaldehyde withβ-ketoesters and hydroxylamine hydrochloride.

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pictograms

Exclamation mark

signalword

Warning

hcodes

Hazard Classifications

Eye Irrit. 2

Clase de almacenamiento

13 - Non Combustible Solids

wgk

WGK 1

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)



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Saurav Brahmachari et al.
Journal of immunology (Baltimore, Md. : 1950), 179(1), 275-283 (2007-06-21)
Experimental allergic encephalomyelitis (EAE) is the animal model for multiple sclerosis. This study explores a novel use of sodium benzoate (NaB), a commonly used food additive and a Food and Drug Administration-approved nontoxic drug for urea cycle disorders, in treating
Huey-Jen Tsay et al.
Neurotoxicology and teratology, 29(5), 562-569 (2007-07-24)
Sodium benzoate (SB) is a commonly used food preservative and anti-microbial agent in many foods from soup to cereals. However, little is known about the SB-induced toxicity and teratogenicity during early embryonic development. Here, we used zebrafish as a model
Eagleson M.
Concise Encyclopedia Chemistry, 121-121 (1994)