1-Hydroxyibuprofen
SIAL/32496 - VETRANAL®, analytical standard
Synonym: 2-
CAS Number: 53949-53-4
Empirical Formula (Hill Notation): C13H18O3
Molecular Weight: 222.28
MDL Number: MFCD08275586
Linear Formula: C13H18O3
Product Type: Chemical
| application(s) | forensics and toxicology pharmaceutical (small molecule) |
| format | neat |
| grade | analytical standard |
| InChI | 1S/C13H18O3/c1-8(2)12(14) |
| InChI key | RMOQYHYFRKTDRI-UHFFFAOYSA |
| product line | VETRANAL® |
| Quality Level | 100 ![]() |
| shelf life | limited shelf life, expiry date on the label |
| SMILES string | CC(C)C(O)c1ccc(cc1)C(C)C( |
| technique(s) | gas chromatography (GC): suitable |
| HPLC: suitable |
| Application: | 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. |
| Application: | Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support. |
| General description: | 1-Hydroxyibuprofen is one of the metabolites of ibuprofen, which is classified under the non-steroidal anti-inflammatory drugs (NSAIDs) group of compounds. |
| Legal Information: | VETRANAL is a registered trademark of Merck KGaA, Darmstadt, Germany |
| Symbol | GHS07 |
| Signal word | Warning |
| Hazard statements | H302 |
| Precautionary statements | P264 - P270 - P301 + P312 - P501 |
| Hazard Codes | Xn |
| Risk Statements | 22 |
| Safety Statements | 36 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | WGK 3 |
| UNSPSC | 41116107 |


