| CAS Number | 1359705-81-9 |
| Catalog Number | AG01AM2R(AGN-PC-0WNW24) |
| Chemical Name | 3-[(4-bromophenyl)methyl]pyrrolidine hydrochloride |
| IUPAC Name | 3-[(4-bromophenyl)methyl]pyrrolidine;hydrochloride |
| InChI | InChI=1S/C11H14BrN.ClH/c12-11-3-1-9(2-4-11)7-10-5-6-13-8-10;/h1-4,10,13H,5-8H2;1H |
| InChI Key | HUEHWKWIOTXRGH-UHFFFAOYSA-N |
| MDL Number | MFCD28111197 |
| Molecular Formula | C11H15BrClN |
| Molecular Weight | 276.6005 |
| SMILES | C1CNCC1CC2=CC=C(C=C2)Br.Cl |
| Synonyms | 3-(4-bromobenzyl)pyrrolidine hydrochloride,
1359705-81-9,
3-[(4-bromophenyl)methyl]pyrrolidine hydrochloride,
AKOS030757388,
DB-012113,
Z2213893385,
N/A,
|
| Complexity | 152 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 275.008g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 276.602g/mol |
| Monoisotopic Mass | 275.008g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number