≥95% 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 | 504753687 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504753687 |
| Canonical Smiles | C=C1OCCCCO1 |
| IUPAC Name | 2-methylidene-1,3-dioxepane |
| InChIKey | AVUFZLGLMCACRE-UHFFFAOYSA-N |
| INCHI | 1S/C6H10O2/c1-6-7-4-2-3-5-8-6/h1-5H2 |
| Isomeric SMILES | C=C1OCCCCO1 |
| Molecular Weight | 114.14 |
| Reaxy-Rn | 1560864 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1560864&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 | Dioxepanes |
| Subclass | 1,3-dioxepanes |
| Intermediate Tree Nodes | Not available |
| Direct Parent | 1,3-dioxepanes |
| Alternative Parents | Ketene acetals Oxacyclic compounds Hydrocarbon derivatives |
| Molecular Framework | Aliphatic heteromonocyclic compounds |
| Substituents | 1,3-dioxepane - Ketene acetal or derivatives - Oxacycle - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as 1,3-dioxepanes. These are dioxepanes with the two ring oxygen atoms at position 1 and 3, respectively. |
| 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 |
|---|---|---|---|
 D2523128 | Certificate of Analysis | Apr 12, 2025 | M194650 |
| D2523129 | Certificate of Analysis | Apr 12, 2025 | M194650 |
| D2607048 | Certificate of Analysis | Apr 12, 2025 | M194650 |
| E2529163 | Certificate of Analysis | Apr 12, 2025 | M194650 |
| I2424520 | Certificate of Analysis | Sep 10, 2024 | M194650 |
| I2424518 | Certificate of Analysis | Sep 10, 2024 | M194650 |
| I2424519 | Certificate of Analysis | Sep 10, 2024 | M194650 |
| G2401053 | Certificate of Analysis | Oct 27, 2023 | M194650 |
| K2306339 | Certificate of Analysis | Oct 27, 2023 | M194650 |
| K2306340 | Certificate of Analysis | Oct 27, 2023 | M194650 |
| K2306341 | Certificate of Analysis | Oct 27, 2023 | M194650 |
| K2306360 | Certificate of Analysis | Oct 27, 2023 | M194650 |
| K2306361 | Certificate of Analysis | Oct 27, 2023 | M194650 |
| Sensitivity | Air and heat sensitive |
|---|---|
| Molecular Weight | 114.140 g/mol |
| XLogP3 | 1.500 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 114.068 Da |
| Monoisotopic Mass | 114.068 Da |
| Topological Polar Surface Area | 18.500 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 78.500 |
| 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 |
