32496

1-Hydroxyibuprofen

VETRANAL^®, analytical standard

• Sinónimos: 2-[4-(1-Hydroxy-2-methylpropyl)phenyl]propionic acid
• Fórmula empírica (notación de Hill): C₁₃H₁₈O₃
• Número de CAS: 53949-53-4
• Peso molecular: 222.28
• Beilstein: 22307543
• Número MDL: MFCD08275586
• Código UNSPSC: 41116107
• ID de la sustancia en PubChem: 329754248
• NACRES: NA.24

Propiedades

• grado: analytical standard
• Nivel de calidad: 100
• Línea del producto: VETRANAL^®
• caducidad: limited shelf life, expiry date on the label
• técnicas: HPLC: suitable; gas chromatography (GC): suitable
• aplicaciones: forensics and toxicology; pharmaceutical (small molecule)
• Formato: neat
• cadena SMILES: CC(C)C(O)c1ccc(cc1)C(C)C(O)=O
• InChI: 1S/C13H18O3/c1-8(2)12(14)11-6-4-10(5-7-11)9(3)13(15)16/h4-9,12,14H,1-3H3,(H,15,16)
• Clave InChI: RMOQYHYFRKTDRI-UHFFFAOYSA-N

Descripción

Descripción general

1-Hydroxyibuprofen is one of the metabolites of ibuprofen, which is classified under the non-steroidal anti-inflammatory drugs (NSAIDs) group of compounds.

Aplicación

1-Hydroxyibuprofen has been used as an analytical reference standard for the determination of the analyte in:

• Sewage sludge samples by QuEChERS (quick, easy, cheap, effective, rugged and safe) extraction with on-line solid-phase extract purification and pre-concentration, followed by analysis using liquid chromatography coupled to electrospray ionization-tandem mass spectrometry (LC-ESI-MS/MS) operating in multiple reaction monitoring (MRM) mode of detection.

It may be used as an analytical reference standard for the determination of the analyte in:

• Human urine samples by ultrasound-assisted emulsification microextraction (USAEME) and ultra-high performance liquid chromatography (UHPLC) with (ESI-MS/MS) with (MRM) detection.
• Wastewater samples by hollow fiber liquid phase microextraction (HF-LPME) followed by LC-ESI-MS/MS.

Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Información legal

VETRANAL is a registered trademark of Merck KGaA, Darmstadt, Germany

Información de seguridad

• Pictogramas: GHS07
• Palabra de señalización: Warning
• Frases de peligro: H302
• Consejos de prudencia: P264 - P270 - P301 + P312 - P501
• Clasificaciones de peligro: Acute Tox. 4 Oral
• Código de clase de almacenamiento: 11 - Combustible Solids
• Clase de riesgo para el agua (WGK): WGK 3