≥97%以上(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships ノーマル 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.
| パブケム・シド | 508814639 |
|---|---|
| カノニカル・スマイル | CCCSCC=C |
| IUPAC Name | 1-prop-2-enylsulfanylpropane |
| InChIKey | JMLIYQJQKZYHDQ-UHFFFAOYSA-N |
| INCHI | 1S/C6H12S/c1-3-5-7-6-4-2/h3H,1,4-6H2,2H3 |
| 異性体SMILES | CCCSCC=C |
| 分子量 | 116.22 |
| Beilstein | 1(3)1889 |
| Reaxy-Rn | 1739379 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1739379&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 | Organosulfur compounds |
| 分類 | Allyl sulfur compounds |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Allyl sulfur compounds |
| Alternative Parents | Sulfenyl compounds Dialkylthioethers Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Allyl sulfur compound - Dialkylthioether - Sulfenyl compound - Thioether - Hydrocarbon derivative - Aliphatic acyclic compound |
| 説明 | This compound belongs to the class of organic compounds known as allyl sulfur compounds. These are compounds containing an allylsulfur group, with the general structure H2C(=CH2)CS. |
| External Descriptors | Not available |
| 屈折率 | 1.47 |
|---|---|
| 引火点（°C） | 30 °C |
| 沸点（°C） | 140 °C |
| 分子量 | 116.230 g/mol |
| XLogP3 | 2.400 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 4 |
| Exact Mass | 116.066 Da |
| Monoisotopic Mass | 116.066 Da |
| Topological Polar Surface Area | 25.300 Ų |
| Heavy Atom Count | 7 |
| Formal Charge | 0 |
| Complexity | 41.400 |
| 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 |
I1613101