| CAS Number | 1219980-55-8 |
| Catalog Number | AG01FOF8(AGN-PC-0WC42I) |
| Chemical Name | N-Benzyl-N-methylpyrrolidin-3-amine dihydrochloride |
| IUPAC Name | N-benzyl-N-methylpyrrolidin-3-amine;dihydrochloride |
| InChI | InChI=1S/C12H18N2.2ClH/c1-14(12-7-8-13-9-12)10-11-5-3-2-4-6-11;;/h2-6,12-13H,7-10H2,1H3;2*1H |
| InChI Key | PRWKKVNQJXCJIZ-UHFFFAOYSA-N |
| Molecular Formula | C12H20Cl2N2 |
| Molecular Weight | 263.2066 |
| SMILES | CN(CC1=CC=CC=C1)C2CCNC2.Cl.Cl |
| Synonyms | N-benzyl-N-methyl-3-pyrrolidinaminedihydrochloride,
N-benzyl-N-methylpyrrolidin-3-amine dihydrochloride,
1219980-55-8,
n-benzyl-n-methyl-3-pyrrolidinamine dihydrochloride,
CTK6I0003,
AKOS015845451,
Z-1499,
|
| Complexity | 164 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 262.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 263.206g/mol |
| Monoisotopic Mass | 262.1g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 15.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number