≥96% 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.
Maximum Absorption Wavelength:381(DMF)nm
| Pubchem Sid | 488189474 |
|---|---|
| Canonical Smiles | C1=CC=C2C(=C1)C(=O)C3=C(S2)C=CC(=C3)Br |
| IUPAC Name | 2-bromothioxanthen-9-one |
| InChIKey | XOYDXFFMXDJBQU-UHFFFAOYSA-N |
| INCHI | 1S/C13H7BrOS/c14-8-5-6-12-10(7-8)13(15)9-3-1-2-4-11(9)16-12/h1-7H |
| Isomeric SMILES | C1=CC=C2C(=C1)C(=O)C3=C(S2)C=CC(=C3)Br |
| Molecular Weight | 291.16 |
| Reaxy-Rn | 172476 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=172476&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 | Organoheterocyclic compounds |
| Class | Thiochromenes |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Thiochromenes |
| Alternative Parents | 1-benzothiopyrans Benzenoids Aryl bromides Heteroaromatic compounds Organooxygen compounds Organobromides Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Thiochromene - 1-benzothiopyran - Benzothiopyran - Benzenoid - Aryl halide - Aryl bromide - Heteroaromatic compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as thiochromenes. These are organosulfur compounds that are analogues to chromene, with the difference that a sulfur atom replaces the oxygen atom. |
| 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 |
|---|---|---|---|
 K2202134 | Certificate of Analysis | Aug 15, 2025 | B405450 |
| K2202135 | Certificate of Analysis | Aug 11, 2025 | B405450 |
| K2202229 | Certificate of Analysis | Aug 11, 2025 | B405450 |
| C2528154 | Certificate of Analysis | Sep 15, 2022 | B405450 |
| Melt Point(°C) | 166 °C |
|---|---|
| Molecular Weight | 291.160 g/mol |
| XLogP3 | 4.700 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 289.94 Da |
| Monoisotopic Mass | 289.94 Da |
| Topological Polar Surface Area | 42.400 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 294.000 |
| 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 |
