| CAS Number | 1803611-21-3 |
| Catalog Number | AG01B8B4 |
| Chemical Name | 3,4-bis(bromomethyl)pyridine hydrobromide |
| IUPAC Name | 3,4-bis(bromomethyl)pyridine;hydrobromide |
| InChI | InChI=1S/C7H7Br2N.BrH/c8-3-6-1-2-10-5-7(6)4-9;/h1-2,5H,3-4H2;1H |
| InChI Key | FJXULAXPLMTGHA-UHFFFAOYSA-N |
| MDL Number | MFCD28246455 |
| Molecular Formula | C7H8Br3N |
| Molecular Weight | 345.8571 |
| SMILES | Br.BrCC1=C(CBr)C=NC=C1 |
| Synonyms | 3,4-bis(bromomethyl)pyridine hydrobromide,
1803611-21-3,
SCHEMBL18547351,
|
| Complexity | 97.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 344.81864g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 345.86g/mol |
| Monoisotopic Mass | 342.82069g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12.9Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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