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Hippuric acid

CAS 495-69-2C9H9NO3MW 179.17

Hippuric acid (CAS 495-69-2) — formula C9H9NO3, molecular weight 179.17.

Product Overview

CAS Number495-69-2
Molecular FormulaC9H9NO3
Molecular Weight179.17
Melting Point187 - 191 °C
LogP0.31

Technical Profile

What this product is

Hippuric acid is a chemical compound with CAS registry number 495-69-2 and molecular formula C9H9NO3 (molecular weight 179.17).

Identification

CAS number: 495-69-2

Its molecular formula C9H9NO3 comprises 9 C, 9 H, 1 N, 3 O atoms.

Also known as: Hippuric acid · 马尿酸

Frequently Asked Questions

What is the CAS number of Hippuric acid?

The CAS registry number of Hippuric acid is 495-69-2.

What is the molecular formula and molecular weight of Hippuric acid?

Molecular formula C9H9NO3, molecular weight 179.17.

What other names is Hippuric acid known by?

It is also registered under: Hippuric acid, 马尿酸.

PubChem Public Data

Independent reference data for Hippuric acid (CAS 495-69-2), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number495-69-2
PubChem CID464
Molecular formulaC9H9NO3
IUPAC name2-benzamidoacetic acid
UNII (FDA)TE0865N2ET

Computed descriptors

Molecular Weight179.17
XLogP30.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass179.058243149
Monoisotopic Mass179.058243149
Topological Polar Surface Area66.4
Heavy Atom Count13

Physicochemical values on record

Melting Point187 - 191 °C
Solubility3.75 mg/mL
Vapor Pressure0.00000076 [mmHg]
LogP0.31
Collision Cross Section153.1 Ų [M+Na]+
Collision Cross Section147.7 Ų [M-H]-
Collision Cross Section149.9 Ų [M+Na]+
Collision Cross Section145.9 Ų [M+H]+
Collision Cross Section142.4 Ų [M-H]-

Documented uses on record

    Found in the urine of herbivorous animals and humans; [Merck Index]Naturally produced by the body (endogenous).

    Synonyms and trade names

    Hippuric acid; 495-69-2; 2-Benzamidoacetic acid; N-Benzoylglycine; Benzoylglycine; Glycine, N-benzoyl-; Benzamidoacetic acid; Benzoylaminoacetic acid; hippurate; Hippursaeure; 2-(Phenylformamido)Acetic Acid; Phenylcarbonylaminoacetic acid; Benzamidoessigsaeure; Benzoylaminoessigsaeure; Acido ippurico; DTXSID9046073

    Regulatory listings held on file

    Regulatory & Food ContactCIR / INCI: Hair conditioning
    GHS notification summary5.2% (3 / 58)

    GHS hazard classification

    GHS notification summary5.2% (3 / 58)
    Reported hazard statementsH302 (93.1%), H315 (94.8%), H318 (93.1%), H335 (93.1%)

    This chemical does not meet GHS hazard criteria for 5.2% (3 of 58) of reports.

    H302 (93.1%): Harmful if swallowed [Warning Acute toxicity, oral]

    What the public record says

    Hippuric acid · CAS 495-69-2 · C9H9NO3. UNII TE0865N2ET. Melting Point: 187 - 191 °C; Solubility: 3.75 mg/mL; Vapor Pressure: 0.00000076 [mmHg].

    Physical description and handling notes

    Source: PubChem / Wikidata; the batch COA governs where values differ.

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