| CAS Number | 90944-49-3 |
| Catalog Number | AG01BEAT |
| Chemical Name | benzyl(2-bromoethyl)methylamine hydrobromide |
| IUPAC Name | N-benzyl-2-bromo-N-methylethanamine;hydrobromide |
| InChI | InChI=1S/C10H14BrN.BrH/c1-12(8-7-11)9-10-5-3-2-4-6-10;/h2-6H,7-9H2,1H3;1H |
| InChI Key | MQLYSVARAPQJGJ-UHFFFAOYSA-N |
| MDL Number | MFCD28064039 |
| Molecular Formula | C10H15Br2N |
| Molecular Weight | 309.0408 |
| SMILES | Br.CN(CC1=CC=CC=C1)CCBr |
| Synonyms | benzyl(2-bromoethyl)methylamine hydrobromide,
90944-49-3,
SCHEMBL10673628,
|
| Complexity | 110 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 308.95508g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 309.04g/mol |
| Monoisotopic Mass | 306.95712g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 3.2Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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