PHR1978
布洛芬相关化合物J
Pharmaceutical Secondary Standard; Certified Reference Material
别名:
(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
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About This Item
经验公式（希尔记法）:
C13H16O3
CAS号:
分子量:
220.26
Beilstein:
2844898
MDL编号:
UNSPSC代码:
41116107
NACRES:
NA.24
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等级
certified reference material
pharmaceutical secondary standard
质量水平
Agency
traceable to USP 1335596
CofA
current certificate can be downloaded
包装
pkg of 50 mg
技术
HPLC: suitable
gas chromatography (GC): suitable
应用
pharmaceutical (small molecule)
包装形式
neat
储存温度
2-30°C
SMILES字符串
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)
InChI key
RCINGEKPKJQCMO-UHFFFAOYSA-N
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相关类别
一般描述
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
应用
- 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).
分析说明
These secondary standards offer multi-traceability to the USP, EP and BP primary standards, where they are available.
其他说明
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.
附注
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.
推荐产品
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.
警示用语：
Warning
危险声明
危险分类
Acute Tox. 4 Oral
储存分类代码
11 - Combustible Solids
WGK
WGK 3
闪点(°F)
Not applicable
闪点(°C)
Not applicable
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