≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature,Argon charged 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 3 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
s-cis-trans isomerism of 2-acetyl-5-methylfuran was investigated by IR and NMR spectroscopy.
| Pubchem Sid | 488181999 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488181999 |
| Canonical Smiles | CC1=CC=C(O1)C(=O)C |
| IUPAC Name | 1-(5-methylfuran-2-yl)ethanone |
| InChIKey | KEFJLCGVTHRGAH-UHFFFAOYSA-N |
| INCHI | 1S/C7H8O2/c1-5-3-4-7(9-5)6(2)8/h3-4H,1-2H3 |
| Isomeric SMILES | CC1=CC=C(O1)C(=O)C |
| WGK Germany | 3 |
| RTECS | LT8528000 |
| Molecular Weight | 124.14 |
| Reaxy-Rn | 110853 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=110853&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 | Heteroaromatic compounds Furans Oxacyclic compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Aryl alkyl ketone - Heteroaromatic compound - Furan - Oxacycle - Organoheterocyclic compound - Organic oxide - Hydrocarbon derivative - 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 | methyl ketone - furans - aromatic ketone |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 K2119207 | Certificate of Analysis | Sep 04, 2025 | A113375 |
| K2119209 | Certificate of Analysis | Sep 04, 2025 | A113375 |
| K2119285 | Certificate of Analysis | Sep 04, 2025 | A113375 |
| L1721022 | Certificate of Analysis | Jul 09, 2025 | A113375 |
| B2105075 | Certificate of Analysis | Dec 13, 2024 | A113375 |
| J1208062 | Certificate of Analysis | Jul 16, 2024 | A113375 |
| A2622106 | Certificate of Analysis | Apr 28, 2024 | A113375 |
| G2416505 | Certificate of Analysis | Apr 28, 2024 | A113375 |
| G2416507 | Certificate of Analysis | Apr 28, 2024 | A113375 |
| B2327313 | Certificate of Analysis | Mar 08, 2023 | A113375 |
| E2311028 | Certificate of Analysis | Oct 22, 2021 | A113375 |
| E2311039 | Certificate of Analysis | Oct 22, 2021 | A113375 |
| Solubility | Slightly soluble in water. Soluble in alcohol. |
|---|---|
| Sensitivity | Air sensitive |
| Refractive Index | 1.512-1.514 |
| Flash Point(°F) | 176 °F |
| Flash Point(°C) | 80℃ |
| Boil Point(°C) | 100-101°C |
| Molecular Weight | 124.140 g/mol |
| XLogP3 | 1.400 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 124.052 Da |
| Monoisotopic Mass | 124.052 Da |
| Topological Polar Surface Area | 30.200 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 120.000 |
| 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 |
| 1. Xiaocao Zhao, Jun Qi, Chaoxia Fan, Bo Wang, Cong Yang, Dengyong Liu. (2022) Ultrasound treatment enhanced the ability of the porcine myofibrillar protein to bind furan compounds: Investigation of underlying mechanisms. FOOD CHEMISTRY, [PMID:35240573] [10.1016/j.foodchem.2022.132472] |
| 2. Xiong Yuannan, Chen Wenqi, Zeng Aiwu. (2016) Optimization for catalytic performances of Hβ zeolite in the acylation of 2-methylfuran by surface modification and solvents effect. RESEARCH ON CHEMICAL INTERMEDIATES, 43 (3): (1557-1574). [PMID:] [10.1007/s11164-016-2715-4] |
| 3. Ying Yu, Chaoxia Fan, Jun Qi, Xiaocao Zhao, Hui Yang, Guoqing Ye, Mingcheng Zhang, Dengyong Liu. (2024) Effect of ultrasound treatment on porcine myofibrillar protein binding furan flavor compounds at different salt concentrations. FOOD CHEMISTRY, [PMID:38277938] [10.1016/j.foodchem.2024.138427] |
