≥99%(GC) 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 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 504752544 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504752544 |
| Canonical Smiles | CC1CCOCO1 |
| IUPAC Name | 4-methyl-1,3-dioxane |
| InChIKey | INCCMBMMWVKEGJ-UHFFFAOYSA-N |
| INCHI | 1S/C5H10O2/c1-5-2-3-6-4-7-5/h5H,2-4H2,1H3 |
| Isomeric SMILES | CC1CCOCO1 |
| RTECS | JH2200000 |
| Molecular Weight | 102.13 |
| Beilstein | 19(3/4)49 |
| Reaxy-Rn | 102735 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=102735&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 | Dioxanes |
| Subclass | 1,3-dioxanes |
| Intermediate Tree Nodes | Not available |
| Direct Parent | 1,3-dioxanes |
| Alternative Parents | Oxacyclic compounds Acetals Hydrocarbon derivatives |
| Molecular Framework | Aliphatic heteromonocyclic compounds |
| Substituents | Meta-dioxane - Oxacycle - Acetal - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as 1,3-dioxanes. These are organic compounds containing 1,3-dioxane, an aliphatic six-member ring with two oxygen atoms in ring positions 1 and 3. |
| 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 |
|---|---|---|---|
 L2102625 | Certificate of Analysis | Sep 09, 2025 | M158047 |
| I2509743 | Certificate of Analysis | Aug 21, 2025 | M158047 |
| I2509744 | Certificate of Analysis | Aug 21, 2025 | M158047 |
| I2509745 | Certificate of Analysis | Aug 21, 2025 | M158047 |
| A2510141 | Certificate of Analysis | Jan 14, 2025 | M158047 |
| G1827114 | Certificate of Analysis | May 11, 2022 | M158047 |
| D2320184 | Certificate of Analysis | Dec 06, 2021 | M158047 |
| Refractive Index | 1.41 |
|---|---|
| Flash Point(°F) | 71.6℉ |
| Flash Point(°C) | 22°C(lit.) |
| Boil Point(°C) | 114 °C |
| Molecular Weight | 102.130 g/mol |
| XLogP3 | 0.600 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 102.068 Da |
| Monoisotopic Mass | 102.068 Da |
| Topological Polar Surface Area | 18.500 Ų |
| Heavy Atom Count | 7 |
| Formal Charge | 0 |
| Complexity | 54.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
| 1. Jiahang Zou, Hanxu Yang, Shilin Wu, Zhengquan Xiao, Zhipeng Jiang, Wangqiang Shen, Yongtao Li. (2024) Tuning steric hindrance of cyclic ether electrolytes enables high-voltage lithium metal batteries. JOURNAL OF COLLOID AND INTERFACE SCIENCE, [PMID:39733543] [10.1016/j.jcis.2024.12.102] |
| 2. Pengjun Wang, Yang Rui, Tianli Hui, Tao Zheng, Rui Zhang, Xianghai Meng, Xiangping Zhang, Zhichang Liu, Haiyan Liu. (2026) Hydrogen-bonding and confinement-enabled one-step immobilization of functional ionic liquids in hierarchical silica for efficient methacrolein synthesis. APPLIED SURFACE SCIENCE, [PMID:] [10.1016/j.apsusc.2026.166170] |
