PHR1978

Ibuprofen Related Compound J

Pharmaceutical Secondary Standard; Certified Reference Material

• Synonyme(s) : (2RS)-2-(4-Isobutyrylphenyl)propionic acid, (2-(4-Isobutyrylphenyl)propanoic acid), α-Methyl-4-(2-methyl-1-oxopropyl)benzeneacetic acid, (2RS)-2-[4-(2-Methylpropanoyl)phenyl]propanoic acid, 1-Oxoibuprofen
• Formule empirique (notation de Hill): C₁₃H₁₆O₃
• Numéro CAS: 65813-55-0
• Poids moléculaire : 220.26
• Numéro Beilstein : 2844898
• Numéro MDL: MFCD08275584
• Code UNSPSC : 41116107
• Nomenclature NACRES : NA.24

Propriétés

• Qualité: certified reference material; pharmaceutical secondary standard
• Niveau de qualité: 300
• Agence: traceable to USP 1335596
• CofA (certificat d'analyse): current certificate can be downloaded
• Conditionnement: pkg of 50 mg
• Technique(s): HPLC: suitable; gas chromatography (GC): suitable
• Application(s): pharmaceutical (small molecule)
• Format: neat
• Température de stockage: 2-30°C
• Chaîne SMILES: OC(C(C)C1=CC=C(C(C(C)C)=O)C=C1)=O
• InChI: 1S/C13H16O3/c1-8(2)12(14)11-6-4-10(5-7-11)9(3)13(15)16/h4-9H,1-3H3,(H,15,16)
• Clé InChI: RCINGEKPKJQCMO-UHFFFAOYSA-N

Description

Description générale

Pharmaceutical secondary standards for application in quality control provide pharma laboratories and manufacturers with a convenient and cost-effective alternative to the preparation of in-house working standards

Application

• Prediction of Potential Toxicity and Side Effect Protein Targets: Research exploring the use of Ibuprofen Related Compound J as part of a ligand-protein inverse docking approach aimed at predicting potential toxicity and side effect protein targets. This innovative method enhances drug safety profiles by identifying off-target interactions early in the drug development process, serving as a critical tool for pharmaceutical research and ensuring the development of safer therapeutic agents (Chen and Ung, 2001).

Remarque sur l'analyse

These secondary standards offer multi-traceability to the USP, EP and BP primary standards, where they are available.

Autres remarques

This Certified Reference Material (CRM) is produced and certified in accordance with ISO 17034 and ISO/IEC 17025. All information regarding the use of this CRM can be found on the certificate of analysis.

Note de bas de page

To see an example of a Certificate of Analysis for this material enter LRAC0769 in the Documents slot below. This is an example certificate only and may not be the lot that you receive.

Produits recommandés

Find a digital Reference Material for this product available on our online platform ChemisTwin® for NMR. You can use this digital equivalent on ChemisTwin® for your sample identity confirmation and compound quantification (with digital external standard). An NMR spectrum of this substance can be viewed and an online comparison against your sample can be performed with a few mouseclicks. Learn more here and start your free trial.

Informations sur la sécurité

• Pictogrammes: GHS07
• Mention d'avertissement: Warning
• Mentions de danger: H302
• Conseils de prudence: P264 - P270 - P301 + P312 - P501
• Classification des risques: Acute Tox. 4 Oral
• Code de la classe de stockage: 11 - Combustible Solids
• Classe de danger pour l'eau (WGK): WGK 3
• Point d'éclair (°F): Not applicable
• Point d'éclair (°C): Not applicable