CAS 495-69-2|Hippuric acid

Introduction:Basic information about CAS 495-69-2|Hippuric acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameHippuric acid
CAS Number495-69-2Molecular Weight179.173
Density1.3±0.1 g/cm3Boiling Point464.1±28.0 °C at 760 mmHg
Molecular FormulaC9H9NO3Melting Point187-191 °C(lit.)
MSDSChineseUSAFlash Point234.5±24.0 °C
Symbol
GHS05, GHS07
Signal WordDanger

Names

NameN-benzoylglycine
SynonymMore Synonyms

Hippuric acid BiologicalActivity

DescriptionHippuric Acid, an acyl glycine produced by the conjugation of benzoic acid and glycine, is a normal component in urine as a metabolite of aromatic compounds from food.
Related CatalogNatural Products >>Acids and AldehydesResearch Areas >>Metabolic Disease
Target

Human Endogenous Metabolite

References

[1]. Niwa T, et al. Organic acids and the uremic syndrome: protein metabolite hypothesis in the progression of chronic renal failure. Semin Nephrol. 1996 May;16(3):167-82.

Chemical & Physical Properties

Density1.3±0.1 g/cm3
Boiling Point464.1±28.0 °C at 760 mmHg
Melting Point187-191 °C(lit.)
Molecular FormulaC9H9NO3
Molecular Weight179.173
Flash Point234.5±24.0 °C
Exact Mass179.058243
PSA66.40000
LogP0.31
Vapour Pressure0.0±1.2 mmHg at 25°C
Index of Refraction1.568
InChIKeyQIAFMBKCNZACKA-UHFFFAOYSA-N
SMILESO=C(O)CNC(=O)c1ccccc1
Storage conditionStore at RT.
StabilityStable. Incompatible with oxidizing agents.

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MR8150000
CHEMICAL NAME :
Hippuric acid
CAS REGISTRY NUMBER :
495-69-2
BEILSTEIN REFERENCE NO. :
1073987
LAST UPDATED :
199701
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C9-H9-N-O3
MOLECULAR WEIGHT :
179.19
WISWESSER LINE NOTATION :
QV1MVR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica, Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year: 112,53,1973

Safety Information

Symbol
GHS05, GHS07
Signal WordDanger
Hazard StatementsH302-H315-H318-H335
Precautionary StatementsP261-P280-P305 + P351 + P338
Personal Protective Equipmentdust mask type N95 (US);Eyeshields;Gloves
Hazard CodesXn,Xi
Risk PhrasesR22
Safety PhrasesS26-S39
RIDADRNONH for all modes of transport
WGK Germany3
RTECSMR8150000
HS Code2924299090

Customs

HS Code2924299090
Summary2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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Synonyms

2-benzamidoacetic acid
BZ-GLY-OH
EINECS 207-806-3
Benzoylaminoacetic acid
Hippuric acid
(benzoylamino)-Acetic acid
Benzoylglycin
(Z)-N-[hydroxy(phenyl)methylidene]glycine
hippuric
N-(benzoyl)glycine
MFCD00002692
N-Benzoylglycine
Glycine, N-benzoyl-
Benzoylglycine
[3H]-Hippuric Acid
BZO-GLY-OH
acidoippurico
N-benzoylaminoacetic acid
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