| CAS Number | 1193388-22-5 |
| Catalog Number | AG019W97(AGN-PC-0WOUE0) |
| Chemical Name | [1-(4-bromophenyl)pyrrolidin-3-yl]methanamine hydrochloride |
| IUPAC Name | [1-(4-bromophenyl)pyrrolidin-3-yl]methanamine;hydrochloride |
| InChI | InChI=1S/C11H15BrN2.ClH/c12-10-1-3-11(4-2-10)14-6-5-9(7-13)8-14;/h1-4,9H,5-8,13H2;1H |
| InChI Key | QIHPELQKLOGZES-UHFFFAOYSA-N |
| MDL Number | MFCD12912922 |
| Molecular Formula | C11H16BrClN2 |
| Molecular Weight | 291.6151 |
| SMILES | Cl.NCC1CN(C2=CC=C(Br)C=C2)CC1 |
| Synonyms | [1-(4-bromophenyl)pyrrolidin-3-yl]methanamine hydrochloride,
1193388-22-5,
AC1Q3D9L,
AKOS026743747,
MCULE-1880714161,
NE15618,
EN300-51098,
|
| Complexity | 178 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 290.019g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 291.617g/mol |
| Monoisotopic Mass | 290.019g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number