| CAS Number | 115002-69-2 |
| Catalog Number | AG01ELVI |
| Chemical Name | dibenzyl(2-bromoethyl)amine hydrobromide |
| IUPAC Name | N,N-dibenzyl-2-bromoethanamine;hydrobromide |
| InChI | InChI=1S/C16H18BrN.BrH/c17-11-12-18(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16;/h1-10H,11-14H2;1H |
| InChI Key | ZALZSRJUWQEWIX-UHFFFAOYSA-N |
| MDL Number | MFCD31668358 |
| Molecular Formula | C16H19Br2N |
| Molecular Weight | 385.1368 |
| SMILES | Br.BrCCN(CC1=CC=CC=C1)CC1=CC=CC=C1 |
| Synonyms | SCHEMBL10680860,
dibenzyl(2-bromoethyl)amine hydrobromide,
115002-69-2,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 384.986g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 385.143g/mol |
| Monoisotopic Mass | 382.988g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 3.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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