| CAS Number | 1803611-57-5 |
| Catalog Number | AG01BHKF(AGN-PC-0WOUTX) |
| Chemical Name | 5-bromo-4-methyl-1,2,3,6-tetrahydropyridine hydrochloride |
| IUPAC Name | 5-bromo-4-methyl-1,2,3,6-tetrahydropyridine;hydrochloride |
| InChI | InChI=1S/C6H10BrN.ClH/c1-5-2-3-8-4-6(5)7;/h8H,2-4H2,1H3;1H |
| InChI Key | BBHHSXAZXOXURY-UHFFFAOYSA-N |
| MDL Number | MFCD28145296 |
| Molecular Formula | C6H11BrClN |
| Molecular Weight | 212.5152 |
| SMILES | Cl.CC1CCNCC=1Br |
| Synonyms | 5-bromo-4-methyl-1,2,3,6-tetrahydropyridine hydrochloride,
1803611-57-5,
AKOS026744065,
|
| Complexity | 118 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.97634g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.51g/mol |
| Monoisotopic Mass | 210.97634g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number