≥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.
| Pubchem Sid | 488191392 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488191392 |
| Kanonisches Lächeln | CC1=CC=C(C=C1)C(=S)N |
| IUPAC Name | 4-methylbenzenecarbothioamide |
| InChIKey | QXYZSNGZMDVLKN-UHFFFAOYSA-N |
| INCHI | 1S/C8H9NS/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3,(H2,9,10) |
| Isomere SMILES | CC1=CC=C(C=C1)C(=S)N |
| WGK Deutschland | 3 |
| Molekulargewicht | 151.23 |
| Reaxy-Rn | 1071973 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1071973&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 | Benzenoids |
| Klasse | Benzene and substituted derivatives |
| Subclass | Toluenes |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Toluenes |
| Alternative Parents | Thioamides Thiocarboxylic acid amides Thiocarbonyl compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Toluene - Thioamide - Thiocarboxylic acid amide - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Thiocarbonyl group - Organosulfur compound - Organonitrogen compound - Aromatic homomonocyclic compound |
| Beschreibung | This compound belongs to the class of organic compounds known as toluenes. These are compounds containing a benzene ring which bears a methane 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 | Datum | Artikel |
|---|---|---|---|
 L2202214 | Certificate of Analysis | Sep 01, 2026 | M140148 |
| L2202225 | Certificate of Analysis | Sep 01, 2026 | M140148 |
| L2202226 | Certificate of Analysis | Sep 01, 2026 | M140148 |
| L2202244 | Certificate of Analysis | Sep 01, 2026 | M140148 |
| L2202246 | Certificate of Analysis | Sep 01, 2026 | M140148 |
| L2202254 | Certificate of Analysis | Sep 01, 2026 | M140148 |
| F1701006 | Certificate of Analysis | Jan 07, 2025 | M140148 |
| Schmelzpunkt (°C) | 170-174°C |
|---|---|
| Molekulargewicht | 151.230 g/mol |
| XLogP3 | 2.000 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 151.046 Da |
| Monoisotopic Mass | 151.046 Da |
| Topological Polar Surface Area | 58.100 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 125.000 |
| 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 |
