≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 504773425 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504773425 |
| Canonical Smiles | C1=CC(=C(C=C1N=C(C2=NON=C2N)NO)Br)F |
| IUPAC Name | 4-amino-N'-(3-bromo-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide |
| InChIKey | ORHZJUSHZUCMKR-UHFFFAOYSA-N |
| INCHI | 1S/C9H7BrFN5O2/c10-5-3-4(1-2-6(5)11)13-9(14-17)7-8(12)16-18-15-7/h1-3,17H,(H2,12,16)(H,13,14) |
| Isomeric SMILES | C1=CC(=C(C=C1N=C(C2=NON=C2N)NO)Br)F |
| PubChem CID | 135741412 |
| Molecular Weight | 316.087 |
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 |
| Class | Benzene and substituted derivatives |
| Subclass | Halobenzenes |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Fluorobenzenes |
| Alternative Parents | Bromobenzenes Imidolactams Aryl fluorides Aryl bromides Heteroaromatic compounds Furazans Oxacyclic compounds Azacyclic compounds Amidines Primary amines Organofluorides Organobromides Organic oxygen compounds Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Bromobenzene - Fluorobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Imidolactam - Heteroaromatic compound - Azole - Furazan - Oxadiazole - Amidine - Oxacycle - Azacycle - Organoheterocyclic compound - Primary amine - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organobromide - Organofluoride - Organonitrogen compound - Aromatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as fluorobenzenes. These are compounds containing one or more fluorine atoms attached to a benzene ring. |
| External Descriptors | Not available |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 H2229245 | Certificate of Analysis | Jun 09, 2025 | Z178183 |
| H2229589 | Certificate of Analysis | Jun 09, 2025 | Z178183 |
| H2229590 | Certificate of Analysis | Jun 09, 2025 | Z178183 |
| H2229591 | Certificate of Analysis | Jun 09, 2025 | Z178183 |
| Solubility | Solubility：≤10mg/ml in ethanol;10mg/ml in DMSO;10mg/ml in dimethyl formamide |
|---|---|
| Molecular Weight | 316.090 g/mol |
| XLogP3 | 1.700 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 314.977 Da |
| Monoisotopic Mass | 314.977 Da |
| Topological Polar Surface Area | 110.000 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 321.000 |
| 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 |
