≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal 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 | 488190326 |
|---|---|
| Canonical Smiles | CC(=O)C1=CN=CN1 |
| IUPAC Name | 1-(1H-imidazol-5-yl)ethanone |
| InChIKey | TUFOJIVMBHBZRQ-UHFFFAOYSA-N |
| INCHI | 1S/C5H6N2O/c1-4(8)5-2-6-3-7-5/h2-3H,1H3,(H,6,7) |
| Isomeric SMILES | CC(=O)C1=CN=CN1 |
| Molecular Weight | 110.11 |
| Reaxy-Rn | 742155 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=742155&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 | Organic oxygen compounds |
| Class | Organooxygen compounds |
| Subclass | Carbonyl compounds |
| Intermediate Tree Nodes | Ketones - Aryl ketones |
| Direct Parent | Aryl alkyl ketones |
| Alternative Parents | Carbonylimidazoles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Aryl alkyl ketone - Imidazole-4-carbonyl group - Heteroaromatic compound - Imidazole - Azole - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as aryl alkyl ketones. These are ketones have the generic structure RC(=O)R', where R = aryl group and R'=alkyl group. |
| 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 |
|---|---|---|---|
 H2025042 | Certificate of Analysis | Mar 20, 2026 | A194232 |
| H2025041 | Certificate of Analysis | Mar 20, 2026 | A194232 |
| H2025039 | Certificate of Analysis | Mar 20, 2026 | A194232 |
| L2216124 | Certificate of Analysis | Sep 17, 2025 | A194232 |
| L2216125 | Certificate of Analysis | Sep 17, 2025 | A194232 |
| L2216126 | Certificate of Analysis | Sep 17, 2025 | A194232 |
| L2216127 | Certificate of Analysis | Sep 17, 2025 | A194232 |
| L2216128 | Certificate of Analysis | Sep 17, 2025 | A194232 |
| L2216129 | Certificate of Analysis | Sep 17, 2025 | A194232 |
| L2216132 | Certificate of Analysis | Sep 17, 2025 | A194232 |
| L2216133 | Certificate of Analysis | Sep 17, 2025 | A194232 |
| L2419202 | Certificate of Analysis | Dec 27, 2024 | A194232 |
| I2109120 | Certificate of Analysis | Jun 03, 2024 | A194232 |
| L2419240 | Certificate of Analysis | Nov 30, 2022 | A194232 |
| Molecular Weight | 110.110 g/mol |
|---|---|
| XLogP3 | 0.100 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 110.048 Da |
| Monoisotopic Mass | 110.048 Da |
| Topological Polar Surface Area | 45.800 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 103.000 |
| 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 |
