Determine the necessary mass, volume, or concentration for preparing a solution.
≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships 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.
| Canonical Smiles | COC1=CC=C(C=C1)CNCC2=CC=CC=C2F.Br |
|---|---|
| IUPAC Name | N-[(2-fluorophenyl)methyl]-1-(4-methoxyphenyl)methanamine;hydrobromide |
| InChIKey | OKKPQQNFXRHAMJ-UHFFFAOYSA-N |
| INCHI | 1S/C15H16FNO.BrH/c1-18-14-8-6-12(7-9-14)10-17-11-13-4-2-3-5-15(13)16;/h2-9,17H,10-11H2,1H3;1H |
| Isomeric SMILES | COC1=CC=C(C=C1)CNCC2=CC=CC=C2F.Br |
| PubChem CID | 75531445 |
| Molecular Weight | 326.2 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
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View spec sheet →| Molecular Weight | 326.200 g/mol |
|---|---|
| XLogP3 | |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 325.048 Da |
| Monoisotopic Mass | 325.048 Da |
| Topological Polar Surface Area | 21.300 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 229.000 |
| 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 | 2 |