≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C,Argon charged Ships Ice chest + Ice pads 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.
| Canonical Smiles | C(C(=O)N)(Br)Br |
|---|---|
| IUPAC Name | 2,2-dibromoacetamide |
| InChIKey | YUIKPESWSMJSMP-UHFFFAOYSA-N |
| INCHI | 1S/C2H3Br2NO/c3-1(4)2(5)6/h1H,(H2,5,6) |
| Isomeric SMILES | C(C(=O)N)(Br)Br |
| Alternate CAS | 598-70-9 |
| NSC Number | 98282 |
| Molecular Weight | 216.86 |
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 acids and derivatives |
| Class | Carboxylic acids and derivatives |
| Subclass | Carboxylic acid derivatives |
| Intermediate Tree Nodes | Carboxylic acid amides |
| Direct Parent | Primary carboxylic acid amides |
| Alternative Parents | Organopnictogen compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl bromides |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Primary carboxylic acid amide - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl bromide - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as primary carboxylic acid amides. These are compounds comprising primary carboxylic acid amide functional group, with the general structure RC(=O)NH2. |
| External Descriptors | Not available |
| Molecular Weight | 216.860 g/mol |
|---|---|
| XLogP3 | 0.800 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 216.856 Da |
| Monoisotopic Mass | 214.858 Da |
| Topological Polar Surface Area | 43.100 Ų |
| Heavy Atom Count | 6 |
| Formal Charge | 0 |
| Complexity | 62.600 |
| 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. Jiang Zhiqiang, Yang Lili, Liu Qinxin, Qiu Meiyue, Chen Yu, Teng Mengying, Zhang Yubin, Liu Xing, Zhao Zhonghua, Zheng Yuxin, Andersen Melvin, Qu Weidong. (2024) Haloacetamides exacerbate non-alcoholic fatty liver disease induced by a high-fat diet in C57BL/6J mice. TOXICOLOGICAL SCIENCES, [PMID:39689017] [10.1093/toxsci/kfae160] |
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