BioReagent BioReagent for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Canonical Smiles | C1=CC=C2C(=C1)C(=O)C(C2=O)C3=NC4=CC=CC=C4C(=C3O)Br |
|---|---|
| IUPAC Name | 2-(4-bromo-3-hydroxyquinolin-2-yl)indene-1,3-dione |
| InChIKey | DVBLPJWQXDCAKU-UHFFFAOYSA-N |
| INCHI | 1S/C18H10BrNO3/c19-14-11-7-3-4-8-12(11)20-15(18(14)23)13-16(21)9-5-1-2-6-10(9)17(13)22/h1-8,13,23H |
| Isomeric SMILES | C1=CC=C2C(=C1)C(=O)C(C2=O)C3=NC4=CC=CC=C4C(=C3O)Br |
| PubChem CID | 25152 |
| Molecular Weight | 368.18 |
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 | Benzenoids |
| Class | Indanes |
| Subclass | Indanones |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Indanediones |
| Alternative Parents | Hydroxyquinolines Haloquinolines Aryl alkyl ketones Hydroxypyridines Beta-diketones Aryl bromides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Indanedione - Hydroxyquinoline - Haloquinoline - Quinoline - Aryl alkyl ketone - Aryl ketone - Hydroxypyridine - 1,3-diketone - Aryl bromide - Aryl halide - 1,3-dicarbonyl compound - Pyridine - Heteroaromatic compound - Ketone - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as indanediones. These are compounds containing an indane ring bearing two ketone groups. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 J2412302 | Certificate of Analysis | Aug 28, 2024 | D693826 |
| J2412303 | Certificate of Analysis | Aug 28, 2024 | D693826 |
| J2412304 | Certificate of Analysis | Aug 28, 2024 | D693826 |
| J2412305 | Certificate of Analysis | Aug 28, 2024 | D693826 |
| J2412306 | Certificate of Analysis | Aug 28, 2024 | D693826 |
| J2412307 | Certificate of Analysis | Aug 28, 2024 | D693826 |
| J2412308 | Certificate of Analysis | Aug 28, 2024 | D693826 |
| J2412309 | Certificate of Analysis | Aug 28, 2024 | D693826 |
| Molecular Weight | 368.200 g/mol |
|---|---|
| XLogP3 | 3.700 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 366.984 Da |
| Monoisotopic Mass | 366.984 Da |
| Topological Polar Surface Area | 67.300 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 486.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
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