≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships 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.
1,3-Dithiolane ,a sulfur containing heterocyclic building block, is a cyclic thioether. Fragmentation modes of 1,3-oxathiolane under electron-impact have been investigated.
| Canonical Smiles | C1CSCS1 |
|---|---|
| IUPAC Name | 1,3-dithiolane |
| InChIKey | IMLSAISZLJGWPP-UHFFFAOYSA-N |
| INCHI | 1S/C3H6S2/c1-2-5-3-4-1/h1-3H2 |
| Isomeric SMILES | C1CSCS1 |
| PubChem CID | 20970 |
| Molecular Weight | 106.21 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
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View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Dithiolanes |
| Subclass | 1,3-dithiolanes |
| Intermediate Tree Nodes | Not available |
| Direct Parent | 1,3-dithiolanes |
| Alternative Parents | Dithioacetals Dialkylthioethers Hydrocarbon derivatives |
| Molecular Framework | Aliphatic heteromonocyclic compounds |
| Substituents | 1,3-dithiolane - Thioacetal - Dialkylthioether - Thioether - Hydrocarbon derivative - Aliphatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as 1,3-dithiolanes. These are organic compounds containing a 1,3-dithiolane ring. 1,3-dithiolane moiety is a 5-membered saturated aliphatic ring with three carbon atoms, and two sulfur atoms at the 1- and 3- ring positions. |
| External Descriptors | dithiolane |
| Refractive Index | n20/D 1.599 (lit.) |
|---|---|
| Flash Point(°F) | 154.4 °F - closed cup |
| Flash Point(°C) | 68 °C - closed cup |
| Boil Point(°C) | 183℃ (lit.) |
| Molecular Weight | 106.210 g/mol |
| XLogP3 | 1.400 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 105.991 Da |
| Monoisotopic Mass | 105.991 Da |
| Topological Polar Surface Area | 50.600 Ų |
| Heavy Atom Count | 5 |
| Formal Charge | 0 |
| Complexity | 24.100 |
| 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 |
