≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C Ships Wet ice 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 5 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 504753344 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504753344 |
| Canonical Smiles | CN(C)C(=S)[S-].CN(C)C(=S)[S-].CN(C)C(=S)[S-].[Fe+3] |
| IUPAC Name | N,N-dimethylcarbamodithioate;iron(3+) |
| InChIKey | WHDGWKAJBYRJJL-UHFFFAOYSA-K |
| INCHI | 1S/3C3H7NS2.Fe/c3*1-4(2)3(5)6;/h3*1-2H3,(H,5,6);/q;;;+3/p-3 |
| Isomeric SMILES | CN(C)C(=S)[S-].CN(C)C(=S)[S-].CN(C)C(=S)[S-].[Fe+3] |
| PubChem CID | 26710 |
| UN Number | 3077 |
| Packing Group | III |
| Molecular Weight | 416.49 |
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 | Organic salts |
| Class | Organic metal salts |
| Subclass | Organic transition metal salts |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Organic transition metal salts |
| Alternative Parents | Organosulfur compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives |
| Molecular Framework | Not available |
| Substituents | Organic transition metal salt - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as organic transition metal salts. These are organic salt compounds containing a transition metal atom in its ionic form. |
| External Descriptors | Dithiocarbamate fungicides |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 H2209468 | Certificate of Analysis | May 20, 2026 | F137780 |
| H1518036 | Certificate of Analysis | Apr 12, 2023 | F137780 |
| I2308634 | Certificate of Analysis | Jan 02, 2023 | F137780 |
| I2308638 | Certificate of Analysis | Jan 02, 2023 | F137780 |
| D2303939 | Certificate of Analysis | Dec 16, 2022 | F137780 |
| D2303959 | Certificate of Analysis | Dec 16, 2022 | F137780 |
| D2303962 | Certificate of Analysis | Dec 16, 2022 | F137780 |
| D2303964 | Certificate of Analysis | Dec 16, 2022 | F137780 |
| Solubility | Insoluble in water; Degree of Solubility in water: 130 mg/l 25 °C; Soluble in Chloroform,Acetone; Slightly soluble in Benzene,Toluene; Very slightly soluble in Ethanol,Methanol |
|---|---|
| Molecular Weight | 416.500 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 0 |
| Exact Mass | 415.917 Da |
| Monoisotopic Mass | 415.917 Da |
| Topological Polar Surface Area | 109.000 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 54.300 |
| 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 | 4 |
| 1. Yan Guo, Xiaojiao Zheng, Xin Wang, Zhuoting Zhang, Shu Qin, Xiaowen Wang, Xu Jing. (2023) Deep eutectic solvent-based adhesive tape extraction combined with enzyme inhibition assay for the determination and distinction of dithiocarbamate pesticides in food samples. TALANTA, [PMID:37149938] [10.1016/j.talanta.2023.124601] |
| 2. Shuang Lin, Xiaoyu Fang, Guoqiang Fang, Fengping Liu, Haoyu Dong, Haiyan Zhao, Jing Zhang, Bin Dong. (2023) Ultrasensitive detection and distinction of pollutants based on SERS assisted by machine learning algorithms. SENSORS AND ACTUATORS B-CHEMICAL, [PMID:] [10.1016/j.snb.2023.133651] |
| 3. Chuhong Zhu, Qiangsheng Zhao, Dexian Huo, Xiaoye Hu, Xiujuan Wang. (2021) Electrodeposition of rough gold nanoarrays for surface-enhanced Raman scattering detection. MATERIALS CHEMISTRY AND PHYSICS, [PMID:] [10.1016/j.matchemphys.2021.124388] |
| 4. Abid Hussain, Hongbin Pu, Bingxue Hu, Da-Wen Sun. (2020) Au@Ag-TGANPs based SERS for facile screening of thiabendazole and ferbam in liquid milk. SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, [PMID:32949944] [10.1016/j.saa.2020.118908] |
| 5. Chuhong Zhu, Xiujuan Wang, Xiaofei Shi, Feng Yang, Guowen Meng, Qizhong Xiong, Yan Ke, Hua Wang, Yilin Lu, Nianqiang Wu. (2017) Detection of Dithiocarbamate Pesticides with a Spongelike Surface-Enhanced Raman Scattering Substrate Made of Reduced Graphene Oxide-Wrapped Silver Nanocubes. ACS Applied Materials & Interfaces, [PMID:29058868] [10.1021/acsami.7b13479] |
