77947

4-(2-Hydroxy-3-isopropylaminopropoxy)phenylacetic acid

analytical standard

• Synonym(s): 4-[2-Hydroxy-3-[(1-methylethyl)amino]propoxy]benzeneacetic acid, Atenolol acid, Metoprolol acid
• Empirical Formula (Hill Notation): C₁₄H₂₁NO₄
• CAS Number: 56392-14-4
• Molecular Weight: 267.32
• MDL number: MFCD00437442
• UNSPSC Code: 41116107
• PubChem Substance ID: 329768040
• NACRES: NA.24

Properties

• grade: analytical standard
• Quality Level: 100
• Assay: ≥97.0% (HPLC)
• shelf life: limited shelf life, expiry date on the label
• technique(s): HPLC: suitable; gas chromatography (GC): suitable
• application(s): forensics and toxicology; pharmaceutical (small molecule)
• format: neat
• storage temp.: 2-8°C
• SMILES string: CC(C)NCC(O)COc1ccc(CC(O)=O)cc1
• InChI: 1S/C14H21NO4/c1-10(2)15-8-12(16)9-19-13-5-3-11(4-6-13)7-14(17)18/h3-6,10,12,15-16H,7-9H2,1-2H3,(H,17,18)
• InChI key: PUQIRTNPJRFRCZ-UHFFFAOYSA-N

Description

General description

4-(2-Hydroxy-3-isopropylaminopropoxy)phenylacetic acid is a metabolite of the selective β-1 blocker drug metoprolol.

Application

4-(2-Hydroxy-3-isopropylaminopropoxy)phenylacetic acid may be used as an analytical standard for the determination of the analyte in environmental water samples, wastewater samples, and human and animal biological samples by various chromatography techniques.

Safety Information

• Storage Class Code: 11 - Combustible Solids
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable