≥96% 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 | 504755903 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504755903 |
| Sourires canoniques | CC1=C(C=C(C=C1)S)C |
| IUPAC Name | 3,4-dimethylbenzenethiol |
| InChIKey | IDKCKPBAFOIONK-UHFFFAOYSA-N |
| INCHI | 1S/C8H10S/c1-6-3-4-8(9)5-7(6)2/h3-5,9H,1-2H3 |
| Isomères SMILES | CC1=C(C=C(C=C1)S)C |
| WGK Allemagne | 3 |
| Poids moléculaire | 138.23 |
| Beilstein | 6(4)3108 |
| Reaxy-Rn | 2040353 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2040353&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 |
| Classe | Thiophenols |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Thiophenols |
| Alternative Parents | o-Xylenes Thiols Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | O-xylene - Xylene - Thiophenol - Monocyclic benzene moiety - Arylthiol - Hydrocarbon derivative - Organosulfur compound - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as thiophenols. These are compounds containing a thiophenol ring, which a phenol derivative obtained by replacing the oxygen atom from the hydroxyl group (attached to the benzene) by a sulfur atom. |
| 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 | Article |
|---|---|---|---|
 F2624329 | Certificate of Analysis | Jun 27, 2026 | D130835 |
| F2624330 | Certificate of Analysis | Jun 27, 2026 | D130835 |
| F2624332 | Certificate of Analysis | Jun 27, 2026 | D130835 |
| D2613088 | Certificate of Analysis | Apr 18, 2026 | D130835 |
| D2525190 | Certificate of Analysis | May 09, 2025 | D130835 |
| D2525191 | Certificate of Analysis | May 09, 2025 | D130835 |
| K2527063 | Certificate of Analysis | May 09, 2025 | D130835 |
| E2430243 | Certificate of Analysis | Jun 19, 2024 | D130835 |
| E2430244 | Certificate of Analysis | Jun 19, 2024 | D130835 |
| E2430245 | Certificate of Analysis | Jun 19, 2024 | D130835 |
| E2430246 | Certificate of Analysis | Jun 19, 2024 | D130835 |
| E2430247 | Certificate of Analysis | Jun 19, 2024 | D130835 |
| E2430248 | Certificate of Analysis | Jun 19, 2024 | D130835 |
| C2211537 | Certificate of Analysis | Apr 30, 2022 | D130835 |
| Indice de réfraction | 1.5736 |
|---|---|
| Point d'éclair (°F) | 194 °F |
| Point d'éclair (°C) | 90 °C |
| Point d'ébullition (°C) | 218°C |
| Poids moléculaire | 138.230 g/mol |
| XLogP3 | 3.300 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 0 |
| Exact Mass | 138.05 Da |
| Monoisotopic Mass | 138.05 Da |
| Topological Polar Surface Area | 1.000 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 90.600 |
| 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 |
