≥95%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C,Argon charged 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 | 488180629 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488180629 |
| Canonical Smiles | C1=COC=CC1=O |
| IUPAC Name | pyran-4-one |
| InChIKey | CVQUWLDCFXOXEN-UHFFFAOYSA-N |
| INCHI | 1S/C5H4O2/c6-5-1-3-7-4-2-5/h1-4H |
| Isomeric SMILES | C1=COC=CC1=O |
| WGK Germany | 3 |
| Molecular Weight | 96.09 |
| Beilstein | 105293 |
| Reaxy-Rn | 105293 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=105293&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 | Pyrans |
| Subclass | Pyranones and derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Pyranones and derivatives |
| Alternative Parents | Heteroaromatic compounds Cyclic ketones Oxacyclic compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Pyranone - Heteroaromatic compound - Cyclic ketone - Oxacycle - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as pyranones and derivatives. These are compounds containing a pyran ring which bears a ketone. |
| External Descriptors | pyranone |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 D2026109 | Certificate of Analysis | Feb 21, 2024 | H157137 |
| F2315073 | Certificate of Analysis | May 24, 2023 | H157137 |
| F2315074 | Certificate of Analysis | May 24, 2023 | H157137 |
| F2315075 | Certificate of Analysis | May 24, 2023 | H157137 |
| D2315638 | Certificate of Analysis | Mar 07, 2023 | H157137 |
| Sensitivity | Moisture sensitive |
|---|---|
| Flash Point(°F) | 213.8 °F |
| Flash Point(°C) | 101 °C |
| Boil Point(°C) | 215°C(lit.) |
| Melt Point(°C) | 32°C(lit.) |
| Molecular Weight | 96.080 g/mol |
| XLogP3 | 0.100 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 96.0211 Da |
| Monoisotopic Mass | 96.0211 Da |
| Topological Polar Surface Area | 26.300 Ų |
| Heavy Atom Count | 7 |
| Formal Charge | 0 |
| Complexity | 119.000 |
| 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 |
