≥97% 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.
| Canonical Smiles | C1=CC=C(C=C1)SC(=O)Cl |
|---|---|
| IUPAC Name | S-phenyl chloromethanethioate |
| InChIKey | HBEFYGYBMKPNSZ-UHFFFAOYSA-N |
| INCHI | 1S/C7H5ClOS/c8-7(9)10-6-4-2-1-3-5-6/h1-5H |
| Isomeric SMILES | C1=CC=C(C=C1)SC(=O)Cl |
| PubChem CID | 83493 |
| Molecular Weight | 172.63 |
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 |
| Class | Thioethers |
| Subclass | Aryl thioethers |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Aryl thioethers |
| Alternative Parents | Benzene and substituted derivatives Organic carbonic acids and derivatives Sulfenyl compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Aryl thioether - Benzenoid - Monocyclic benzene moiety - Carbonic acid derivative - Sulfenyl compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organohalogen compound - Carbonyl group - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by an aryl group. |
| 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 |
|---|---|---|---|
 H2420128 | Certificate of Analysis | Aug 07, 2024 | P140289 |
| H2420172 | Certificate of Analysis | Aug 07, 2024 | P140289 |
| H2420173 | Certificate of Analysis | Aug 07, 2024 | P140289 |
| H2420174 | Certificate of Analysis | Aug 07, 2024 | P140289 |
| Sensitivity | Moisture Sensitive |
|---|---|
| Flash Point(°F) | 221°F |
| Flash Point(°C) | 105℃ |
| Boil Point(°C) | 107°/10mm |
| Molecular Weight | 172.630 g/mol |
| XLogP3 | 3.300 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 171.975 Da |
| Monoisotopic Mass | 171.975 Da |
| Topological Polar Surface Area | 42.400 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 121.000 |
| 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 |
