| CAS Number | 105479-10-5 |
| Catalog Number | AG01AGR3(AGN-PC-0OUS4D) |
| Chemical Name | Benzyl[2-(pyrrolidin-1-yl)ethyl]amine dihydrochloride |
| IUPAC Name | N-benzyl-2-pyrrolidin-1-ylethanamine;dihydrochloride |
| InChI | InChI=1S/C13H20N2.2ClH/c1-2-6-13(7-3-1)12-14-8-11-15-9-4-5-10-15;;/h1-3,6-7,14H,4-5,8-12H2;2*1H |
| InChI Key | GTZOHQCWBRZKMN-UHFFFAOYSA-N |
| MDL Number | MFCD18089533 |
| Molecular Formula | C13H22Cl2N2 |
| Molecular Weight | 277.2332 |
| SMILES | Cl.Cl.C(NCC1=CC=CC=C1)CN1CCCC1 |
| Synonyms | benzyl[2-(pyrrolidin-1-yl)ethyl]amine dihydrochloride,
105479-10-5,
AC1Q3A24,
SCHEMBL5754930,
NE52414,
EN300-72605,
|
| Complexity | 158 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 276.116g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 277.233g/mol |
| Monoisotopic Mass | 276.116g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 15.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number