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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 | B(C1=C2C=CC=C(C2=CC=C1)[N+](=O)[O-])(O)O |
|---|---|
| IUPAC Name | (5-nitronaphthalen-1-yl)boronic acid |
| InChIKey | RUOYOYRRCNVZAM-UHFFFAOYSA-N |
| INCHI | 1S/C10H8BNO4/c13-11(14)9-5-1-4-8-7(9)3-2-6-10(8)12(15)16/h1-6,13-14H |
| Isomeric SMILES | B(C1=C2C=CC=C(C2=CC=C1)[N+](=O)[O-])(O)O |
| PubChem CID | 75486135 |
| Molecular Weight | 216.99 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
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View spec sheet →| Molecular Weight | 216.990 g/mol |
|---|---|
| XLogP3 | |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 217.055 Da |
| Monoisotopic Mass | 217.055 Da |
| Topological Polar Surface Area | 86.300 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 268.000 |
| 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 |