| CAS Number | 89796-23-6 |
| Catalog Number | AG00J2EW |
| Chemical Name | 3-(bromomethyl)-1-methylpiperidine hydrobromide |
| IUPAC Name | 3-(bromomethyl)-1-methylpiperidine;hydrobromide |
| InChI | InChI=1S/C7H14BrN.BrH/c1-9-4-2-3-7(5-8)6-9;/h7H,2-6H2,1H3;1H |
| InChI Key | DLHCVBOOBNKDEH-UHFFFAOYSA-N |
| MDL Number | MFCD00101673 |
| Molecular Formula | C7H15Br2N |
| Molecular Weight | 273.0087 |
| SMILES | N1(C)CCCC(CBr)C1.Br |
| Synonyms | 3-(bromomethyl)-1-methylpiperidine hydrobromide,
89796-23-6,
ZX-CM009347,
MFCD00101673,
AKOS015907957,
3-Bromomethyl-1-methyl-piperidine Hydrobromide,
I14-25816,
3-(Bromomethyl)-1-methylpiperidine hydrobromide, AldrichCPR,
41886-04-8,
|
| Complexity | 85 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 272.955g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 273.012g/mol |
| Monoisotopic Mass | 270.957g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 3.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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