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
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About This Item
Empirical Formula (Hill Notation):
C14H21NO4
CAS Number:
Molecular Weight:
267.32
NACRES:
NA.24
PubChem Substance ID:
UNSPSC Code:
41116107
MDL number:
grade
analytical standard
Quality Segment
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
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.
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
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The
Small Animal Clinical Pharmacology, 241, 484-493 (2011)
Investigation of pharmaceuticals and their metabolites in Brazilian hospital wastewater by LC-QTOF MS screening combined with a preliminary exposure and in silico risk assessment
Becker RW, et al.
The Science of the Total Environment, 699, 134218-134218 (2020)
Screening hundreds of emerging organic pollutants (EOPs) in surface water from the Yangtze River Delta (YRD): occurrence, distribution, ecological risk
Peng Y, et al.
Environmental Pollution (Barking, Essex : 1987), 241, 484-493 (2018)
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 84110-250MG | 04061833006849 |
| 324374-5GM | 04055977216455 |
| 793082P-100MG | 04065273420944 |
| 77947-25MG | 04061832941035 |