ChemicalBook--->CAS DataBase List--->114-70-5

114-70-5

114-70-5 Structure

114-70-5 Structure
IdentificationMore
[Name]

Sodium phenylacetate
[CAS]

114-70-5
[Synonyms]

NAPA
PHENYLACETIC ACID SODIUM SALT
SODIUM PHENYLACETATE
benzeneaceticacid,sodiumsalt
phenylacetatesodiumsalt
phenyl-aceticacisodiumsalt
phenylessigsaurenatrium-salz
sodiumbenzeneacetate
Phenylacetate Sodium
Sodium α-toluate
PhenylaceticAcidSodium
(2R)-2-Phenyloxirane
[EINECS(EC#)]

204-052-7
[Molecular Formula]

C8H7NaO2
[MDL Number]

MFCD00065945
[Molecular Weight]

158.13
[MOL File]

114-70-5.mol
Chemical PropertiesBack Directory
[Appearance]

Soluble in water; insoluble in alcohol, ether, and ketones; 50% aqueous solution has p H 7.0–8.5 and is pale yellow. Solution tends to crys- tallize at 15C.
[Boiling point ]

265.5℃[at 101 325 Pa]
[density ]

1.164[at 20℃]
[vapor pressure ]

0Pa at 25℃
[Stability:]

n/a
[Water Solubility ]

1000g/L at 25℃
[InChI]

InChI=1S/C8H8O2.Na.H/c9-8(10)6-7-4-2-1-3-5-7;;/h1-5H,6H2,(H,9,10);;
[InChIKey]

CNCFCOZYNGYSTM-UHFFFAOYSA-N
[SMILES]

C(C1C=CC=CC=1)C(=O)O.[NaH]
[LogP]

-2.016 at 25℃
[CAS DataBase Reference]

114-70-5(CAS DataBase Reference)
[EPA Substance Registry System]

114-70-5(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)
GHS05
[Signal word ]

Danger
[Hazard statements ]

H318
[Precautionary statements ]

P280-P305+P351+P338-P310
[TSCA ]

TSCA listed
[REACH Registrations]

Inactive
[Hazardous Substances Data]

114-70-5(Hazardous Substances Data)
Raw materials And Preparation ProductsBack Directory
[Preparation Products]

fluorescent whitening agent OM-->2-Bromo-2-phenylacetic acid-->Benzeneaceticacid, a-(2-hydroxyethyl)--->Benzeneacetic acid, α-[(4-hydroxy-3-methoxyphenyl)methylene]--->endo-N-Hydroxy-5-norbornene-2,3-dicarboximide, 97-->phenylacetyl bromide
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Phenylacetic acid sodium salt(114-70-5).msds
Hazard InformationBack Directory
[Chemical Properties]

Soluble in water; insoluble in alcohol, ether, and ketones; 50% aqueous solution has p H 7.0–8.5 and is pale yellow. Solution tends to crys- tallize at 15C.
[Purification Methods]

Its aqueous solution is evaporated to crystallisation on a steam bath; the crystals are washed with absolute EtOH and dried under vacuum at 80o. [Beilstein 9 IV 1614.]
Questions And AnswerBack Directory
[Uses]

Sodium phenylacetate is pale yellow in aqueous solution. It is used as a precursor in production of penicillin G; intermediate for producing heavy metal salts which act as fungicides. Used with sodium benzoate for the treatment of acute hyperammonemia and associated encephalopathy in patients with deficiencies in enzymes of the urea cycle.
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

114-70-5(sigmaaldrich)
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