≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C Ships Wet ice 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.
| Pubchem Sid | 504767232 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504767232 |
| Canonical Smiles | CC(=O)C1=CNC2=C1C=CC=N2 |
| IUPAC Name | 1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone |
| InChIKey | OGMZQWPOZWMDQS-UHFFFAOYSA-N |
| INCHI | 1S/C9H8N2O/c1-6(12)8-5-11-9-7(8)3-2-4-10-9/h2-5H,1H3,(H,10,11) |
| Isomeric SMILES | CC(=O)C1=CNC2=C1C=CC=N2 |
| WGK Germany | 3 |
| Molecular Weight | 160.18 |
| Reaxy-Rn | 4391716 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4391716&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 | Pyrrolopyridines |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Pyrrolopyridines |
| Alternative Parents | Aryl alkyl ketones Substituted pyrroles Pyridines and derivatives Vinylogous amides Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Pyrrolopyridine - Aryl ketone - Aryl alkyl ketone - Pyridine - Substituted pyrrole - Vinylogous amide - Pyrrole - Heteroaromatic compound - Ketone - Azacycle - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as pyrrolopyridines. These are compounds containing a pyrrolopyridine moiety, which consists of a pyrrole ring fused to a pyridine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyridine is a 6-membered ring consisting of five carbon atoms and one nitrogen center. |
| 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 |
|---|---|---|---|
 L2427228 | Certificate of Analysis | Apr 02, 2024 | A186818 |
| L2427231 | Certificate of Analysis | Apr 02, 2024 | A186818 |
| L2427232 | Certificate of Analysis | Apr 02, 2024 | A186818 |
| I2321082 | Certificate of Analysis | Sep 09, 2023 | A186818 |
| I2321083 | Certificate of Analysis | Sep 09, 2023 | A186818 |
| I2321114 | Certificate of Analysis | Sep 09, 2023 | A186818 |
| I2321129 | Certificate of Analysis | Sep 09, 2023 | A186818 |
| I2321130 | Certificate of Analysis | Sep 09, 2023 | A186818 |
| I2321145 | Certificate of Analysis | Sep 09, 2023 | A186818 |
| Molecular Weight | 160.170 g/mol |
|---|---|
| XLogP3 | 1.000 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 160.064 Da |
| Monoisotopic Mass | 160.064 Da |
| Topological Polar Surface Area | 45.800 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 193.000 |
| 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 |
