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Product Overview

Product Code

TRC-H942860

CAS Number

51146-55-5

Product Format

Neat

Molecular Formula

C13 H18 O3

Molecular Weight

222.28

API Family

Ibuprofen

Product Categories

Mycotoxin Research and Reference Materials , Non-steroidal anti-inflammatory drugs (NSAIDs), TRC, Non-steroidal anti-inflammatory drugs (NSAIDs), Forensic and Toxicology Reference Materials, Impurity Reference Materials , Non-steroidal anti-inflammatory drugs (NSAIDs), Analgesics, Pharmaceutical, Veterinary Compound & Metabolite Reference Materials , Pharmaceutical and Veterinary Residue Reference Materials , Pharmaceutical and veterinary compounds and metabolites Reference Materials

Product Type

Impurity, Metabolite

Drug Type

Other Drugs & Biomarkers

Documentation

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Product Information

Chemical Data

Analyte Name

2-[4-(2-Hydroxy-2-methylpropyl)phenyl]propanoic Acid (2-Hydroxyibuprofen)

CAS Number

51146-55-5

Molecular Formula

C13 H18 O3

Molecular Weight

222.28

Accurate Mass

222.1256

Melting Point

124-128

Flash Point

Color

White

Odor

Odourless

SMILES

CC(C(=O)O)c1ccc(CC(C)(C)O)cc1

InChI

InChI=1S/C13H18O3/c1-9(12(14)15)11-6-4-10(5-7-11)8-13(2,3)16/h4-7,9,16H,8H2,1-3H3,(H,14,15)

IUPAC

2-[4-(2-hydroxy-2-methylpropyl)phenyl]propanoic acid

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Ibuprofen

Product Description

A human metabolite of Ibuprofen.

References: Bales, J., et al.: Clin. Chem., 31, 757 (1985),

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Product Overview

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