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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 | CCOCCNC1=C(C=C(C=N1)Br)[N+](=O)[O-] |
|---|---|
| IUPAC Name | 5-bromo-N-(2-ethoxyethyl)-3-nitropyridin-2-amine |
| InChIKey | FCKDYOZYGDBJRZ-UHFFFAOYSA-N |
| INCHI | 1S/C9H12BrN3O3/c1-2-16-4-3-11-9-8(13(14)15)5-7(10)6-12-9/h5-6H,2-4H2,1H3,(H,11,12) |
| Isomeric SMILES | CCOCCNC1=C(C=C(C=N1)Br)[N+](=O)[O-] |
| PubChem CID | 61229812 |
| Molecular Weight | 290.11 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
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View spec sheet →| Molecular Weight | 290.110 g/mol |
|---|---|
| XLogP3 | 2.500 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 289.006 Da |
| Monoisotopic Mass | 289.006 Da |
| Topological Polar Surface Area | 80.000 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 225.000 |
| 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 |