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Merck
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주요 문서

PHR1978

Supelco

Ibuprofen Related Compound J

Pharmaceutical Secondary Standard; Certified Reference Material

동의어(들):

(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

실험식(Hill 표기법):
C13H16O3
CAS Number:
Molecular Weight:
220.26
Beilstein:
2844898
MDL number:
UNSPSC 코드:
41116107
NACRES:
NA.24

Grade

certified reference material
pharmaceutical secondary standard

Quality Level

Agency

traceable to USP 1335596

CofA

current certificate can be downloaded

포장

pkg of 50 mg

기술

HPLC: suitable
gas chromatography (GC): suitable

응용 분야

pharmaceutical (small molecule)

형식

neat

저장 온도

2-30°C

SMILES string

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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일반 설명

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

애플리케이션


  • 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).

분석 메모

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

기타 정보

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.

각주

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.

추천 제품

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.

픽토그램

Exclamation mark

신호어

Warning

유해 및 위험 성명서

예방조치 성명서

Hazard Classifications

Acute Tox. 4 Oral

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point (°F)

Not applicable

Flash Point (°C)

Not applicable


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