≥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.
3-Amino-5-nitrobenzisothiazole forms 1:1 complex with β-cyclodextrin (β-CDx). Structural and photoprototropic features of this complex have been investigated.
| Pubchem Sid | 504757430 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504757430 |
| Canonical Smiles | C1=CC2=C(C=C1[N+](=O)[O-])C(=NS2)N |
| IUPAC Name | 5-nitro-1,2-benzothiazol-3-amine |
| InChIKey | LDTCWISGJYTXDC-UHFFFAOYSA-N |
| INCHI | 1S/C7H5N3O2S/c8-7-5-3-4(10(11)12)1-2-6(5)13-9-7/h1-3H,(H2,8,9) |
| Isomeric SMILES | C1=CC2=C(C=C1[N+](=O)[O-])C(=NS2)N |
| WGK Germany | 3 |
| Molecular Weight | 195.2 |
| Reaxy-Rn | 6970394 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6970394&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 | Organoheterocyclic compounds |
| Class | Benzothiazoles |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzothiazoles |
| Alternative Parents | Nitroaromatic compounds Imidolactams Benzenoids Aminothiazoles Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Primary amines Organopnictogen compounds Organic zwitterions Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | 1,2-benzothiazole - Nitroaromatic compound - 1,2-thiazolamine - Benzenoid - Imidolactam - Azole - Thiazole - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Organic oxoazanium - Azacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Organic oxide - Organic zwitterion - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as benzothiazoles. These are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one 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 | Item |
|---|---|---|---|
 H2209045 | Certificate of Analysis | May 20, 2026 | A151320 |
| G2412317 | Certificate of Analysis | Apr 26, 2024 | A151320 |
| G2412318 | Certificate of Analysis | Apr 26, 2024 | A151320 |
| E2008126 | Certificate of Analysis | Jan 30, 2024 | A151320 |
| E2319070 | Certificate of Analysis | Jun 17, 2022 | A151320 |
| Melt Point(°C) | 250 °C |
|---|---|
| Molecular Weight | 195.200 g/mol |
| XLogP3 | 1.800 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 0 |
| Exact Mass | 195.01 Da |
| Monoisotopic Mass | 195.01 Da |
| Topological Polar Surface Area | 113.000 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 220.000 |
| 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 |
![3-Amino-5-nitrobenz[d]isothiazole - ≥97% CAS No(84387-89-3) by Aladdin Scientific](https://www.aladdinsci.com/media/catalog/product/cache/207e23213cf636ccdef205098cf3c8a3/A/1/A151320.png)