Determine the necessary mass, volume, or concentration for preparing a solution.
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Indoprofen is a non-steroidal drug, which can show a range of pharmacological properties such as analgesic and anti-inflammatory activities. Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.
| ALogP | 2.8 |
|---|
| Sonrisas canónicas | CC(C1=CC=C(C=C1)N2CC3=CC=CC=C3C2=O)C(=O)O |
|---|---|
| IUPAC Name | 2-[4-(3-oxo-1H-isoindol-2-yl)phenyl]propanoic acid |
| InChIKey | RJMIEHBSYVWVIN-UHFFFAOYSA-N |
| INCHI | 1S/C17H15NO3/c1-11(17(20)21)12-6-8-14(9-7-12)18-10-13-4-2-3-5-15(13)16(18)19/h2-9,11H,10H2,1H3,(H,20,21) |
| Isómeros SMILES | CC(C1=CC=C(C=C1)N2CC3=CC=CC=C3C2=O)C(=O)O |
| WGK Alemania | 3 |
| RTECS | MU6645000 |
| Peso molecular | 281.31 |
| Reaxy-Rn | 1543920 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1543920&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Phenylpropanoids and polyketides |
| Clase | Phenylpropanoic acids |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Phenylpropanoic acids |
| Alternative Parents | Isoindolones Isoindoles Benzene and substituted derivatives Tertiary carboxylic acid amides Lactams Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | 2-phenylpropanoic-acid - Isoindolone - Isoindoline - Isoindole - Isoindole or derivatives - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid. |
| External Descriptors | monocarboxylic acid - gamma-lactam - isoindoles |
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| Peso molecular | 281.300 g/mol |
|---|---|
| XLogP3 | 2.800 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 281.105 Da |
| Monoisotopic Mass | 281.105 Da |
| Topological Polar Surface Area | 57.600 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 414.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
| 1. Xue Shu-Wen, Li Jing, Xu Li. (2017) Preparation of magnetic melamine-formaldehyde resin and its application to extract nonsteroidal anti-inflammatory drugs. ANALYTICAL AND BIOANALYTICAL CHEMISTRY, 409 (12): (3103-3113). [PMID:28224244] [10.1007/s00216-017-0251-8] |
| 2. Luo Zhi-yuan, Li Zhi-yong, Liu Hai-yan, Tang Min-qiong, Shi Zhi-guo. (2015) Click chemistry-based synthesis of water-dispersible hydrophobic magnetic nanoparticles for use in solid phase extraction of non-steroidal anti-inflammatory drugs. MICROCHIMICA ACTA, 182 (15): (2585-2591). [PMID:] [10.1007/s00604-015-1638-x] |
| 3. Yuanjing Lin, Jialiang Guo, Hang Lin, Jincai Wang, Govert W. Somsen, Jacques Crommen, Zhengjin Jiang. (2017) Effect of fabrication strategy on the enantioseparation performance of β-cyclodextrin-functionalized polymethacrylate monoliths: A comparative evaluation. JOURNAL OF SEPARATION SCIENCE, 40 (19): (3754-3762). [PMID:28749038] [10.1002/jssc.201700424] |
| 4. Jialiang Guo, Yuan Xiao, Yuanjing Lin, Jacques Crommen, Zhengjin Jiang. (2016) Effect of the crosslinker type on the enantioseparation performance of β-cyclodextrin functionalized monoliths prepared by the one-pot approach. JOURNAL OF CHROMATOGRAPHY A, [PMID:27268520] [10.1016/j.chroma.2016.05.078] |
| 5. Jialiang Guo, Yuan Xiao, Yuanjing Lin, Qiaoxuan Zhang, Yiqun Chang, Jacques Crommen, Zhengjin Jiang. (2016) Influence of the linking spacer length and type on the enantioseparation ability of β-cyclodextrin functionalized monoliths. TALANTA, [PMID:26992519] [10.1016/j.talanta.2016.02.016] |