≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature,Argon charged 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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
3,5-Dimethylbenzenethiol is an organic building block. It is also referred to as 5-mercapto-m-xylene.
3,5-Dimethylbenzenethiol may be employed as a starting reagent in the preparation of Lithium 2-lithio-3,5-dimethylbenzenethiolate. It may also be used in the preparation of 1,1,2-trichloro-4-(3,5-dimethylphenylthio)-1-buten-3-yne and 1,1,2,4-tetrachloro-4-(3,5-dimethylphenylthio)-1,3-butadiene.
| Pubchem Sid | 508809120 |
|---|---|
| 정식 스마일 | CC1=CC(=CC(=C1)S)C |
| IUPAC Name | 3,5-dimethylbenzenethiol |
| InChIKey | CESBAYSBPMVAEI-UHFFFAOYSA-N |
| INCHI | 1S/C8H10S/c1-6-3-7(2)5-8(9)4-6/h3-5,9H,1-2H3 |
| 이성체 SMILES | CC1=CC(=CC(=C1)S)C |
| WGK 독일 | 2 |
| 분자량 | 138.23 |
| Reaxy-Rn | 3233085 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3233085&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 |
| 분류 | Thiophenols |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Thiophenols |
| Alternative Parents | m-Xylenes Thiols Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | M-xylene - Xylene - Thiophenol - Monocyclic benzene moiety - Arylthiol - Hydrocarbon derivative - Organosulfur compound - Aromatic homomonocyclic compound |
| 설명 | 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 | 날짜 | 항목 |
|---|---|---|---|
 E1922084 | Certificate of Analysis | Jul 07, 2026 | D101802 |
| D2623104 | Certificate of Analysis | Mar 03, 2026 | D101802 |
| D2623140 | Certificate of Analysis | Mar 03, 2026 | D101802 |
| D2623141 | Certificate of Analysis | Mar 03, 2026 | D101802 |
| L2106156 | Certificate of Analysis | Jun 06, 2025 | D101802 |
| L2106157 | Certificate of Analysis | Jun 06, 2025 | D101802 |
| A2008056 | Certificate of Analysis | May 12, 2025 | D101802 |
| F2506363 | Certificate of Analysis | Jun 24, 2024 | D101802 |
| J1812124 | Certificate of Analysis | Feb 20, 2024 | D101802 |
| 감도 | air sensitive |
|---|---|
| 굴절률 | 1.568 |
| 발화점(°F) | 185°F |
| 발화점(°C) | 85°C |
| 끓는점(°C) | 127.5°C/50mmHg |
| 분자량 | 138.230 g/mol |
| XLogP3 | 2.900 |
| 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 | 80.600 |
| 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 |
| 1. Liu Xu, Xu Wen Wu, Huang Xinyu, Wang Endong, Cai Xiao, Zhao Yue, Li Jin, Xiao Min, Zhang Chunfeng, Gao Yi, Ding Weiping, Zhu Yan. (2020) De novo design of Au36(SR)24 nanoclusters. Nature Communications, 11 (1): (1-7). [PMID:32620825] [10.1038/s41467-020-17132-5] |
