≥98%(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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488189664 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488189664 |
| Canonical Smiles | CC1(OC2COC(=O)C2O1)C |
| IUPAC Name | (3aR,6aR)-2,2-dimethyl-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxol-4-one |
| InChIKey | WHPSMBYLYRPVGU-RFZPGFLSSA-N |
| INCHI | 1S/C7H10O4/c1-7(2)10-4-3-9-6(8)5(4)11-7/h4-5H,3H2,1-2H3/t4-,5-/m1/s1 |
| Isomeric SMILES | CC1(O[C@@H]2COC(=O)[C@@H]2O1)C |
| WGK Germany | 3 |
| Molecular Weight | 158.15 |
| Beilstein | 1282950 |
| Reaxy-Rn | 1618682 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1618682&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 | Ethers |
| Intermediate Tree Nodes | Acetals |
| Direct Parent | Ketals |
| Alternative Parents | Gamma butyrolactones Tetrahydrofurans 1,3-dioxolanes Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic heteropolycyclic compounds |
| Substituents | Ketal - Gamma butyrolactone - Tetrahydrofuran - Meta-dioxolane - Lactone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxide - Hydrocarbon derivative - Carbonyl group - Aliphatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as ketals. These are acetals derived from ketones by replacement of the oxo group by two hydrocarbyloxy groups R2C(OR)2 ( R not Hydrogen ). This term, once abandoned, has been reinstated as a subclass of acetals. |
| External Descriptors | Not available |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 K2522013 | Certificate of Analysis | Nov 24, 2025 | O159978 |
| E2008160 | Certificate of Analysis | Feb 23, 2024 | O159978 |
| D2324186 | Certificate of Analysis | Aug 03, 2022 | O159978 |
| D2324187 | Certificate of Analysis | Aug 03, 2022 | O159978 |
| K22181013 | Certificate of Analysis | Aug 03, 2022 | O159978 |
| K22181023 | Certificate of Analysis | Aug 03, 2022 | O159978 |
| K2218925 | Certificate of Analysis | Aug 03, 2022 | O159978 |
| K2218999 | Certificate of Analysis | Aug 03, 2022 | O159978 |
| Solubility | Soluble in water |
|---|---|
| Specific Rotation[α] | -117° (C=1,H2O) |
| Melt Point(°C) | 67-69 °C |
| Molecular Weight | 158.150 g/mol |
| XLogP3 | 0.200 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 0 |
| Exact Mass | 158.058 Da |
| Monoisotopic Mass | 158.058 Da |
| Topological Polar Surface Area | 44.800 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 199.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| 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 |
