≥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)NC2=NNC(=S)S2)Cl |
|---|---|
| IUPAC Name | 5-(2-chloroanilino)-3H-1,3,4-thiadiazole-2-thione |
| InChIKey | DXNZMIGMBVWIRQ-UHFFFAOYSA-N |
| INCHI | 1S/C8H6ClN3S2/c9-5-3-1-2-4-6(5)10-7-11-12-8(13)14-7/h1-4H,(H,10,11)(H,12,13) |
| Molecular Weight | 243.7 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
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View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Benzene and substituted derivatives |
| Subclass | Aniline and substituted anilines |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Aniline and substituted anilines |
| Alternative Parents | Chlorobenzenes Aryl chlorides 2-amino-1,3,4-thiadiazoles Heteroaromatic compounds Secondary amines Azacyclic compounds Organosulfur compounds Organopnictogen compounds Organochlorides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Aniline or substituted anilines - Chlorobenzene - Halobenzene - 2-amino-1,3,4-thiadiazole - Aryl chloride - Aryl halide - Azole - Heteroaromatic compound - Thiadiazole - Azacycle - Secondary amine - Organoheterocyclic compound - Organosulfur compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organopnictogen compound - Aromatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as aniline and substituted anilines. These are organic compounds containing an aminobenzene moiety. |
| External Descriptors | Not available |
| Molecular Weight | 243.700 g/mol |
|---|---|
| XLogP3 | 2.900 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 242.969 Da |
| Monoisotopic Mass | 242.969 Da |
| Topological Polar Surface Area | 93.800 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 269.000 |
| 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 |
![5-[(2-Chlorophenyl)amino]-1,3,4-thiadiazole-2-thiol - ≥97% , CAS No.37844-22-7](https://www.aladdinsci.com/media/catalog/product/placeholder/default/default_4.jpg)