| CAS Number | 959958-19-1 |
| Catalog Number | AG01C08V |
| Chemical Name | (1-Benzyl-4-methylpyrrolidin-3-YL)methanamine |
| IUPAC Name | (1-benzyl-4-methylpyrrolidin-3-yl)methanamine |
| InChI | InChI=1S/C13H20N2/c1-11-8-15(10-13(11)7-14)9-12-5-3-2-4-6-12/h2-6,11,13H,7-10,14H2,1H3 |
| InChI Key | GLFBPDDMMVIVQJ-UHFFFAOYSA-N |
| MDL Number | MFCD09910206 |
| Molecular Formula | C13H20N2 |
| Molecular Weight | 204.3113 |
| SMILES | CC1C(CN)CN(CC2=CC=CC=C2)C1 |
| Synonyms | (1-BENZYL-4-METHYLPYRROLIDIN-3-YL)METHANAMINE,
959958-19-1,
C-(1-Benzyl-4-methyl-pyrrolidin-3-yl)-methylamine,
SCHEMBL500305,
CTK7E6800,
GLFBPDDMMVIVQJ-UHFFFAOYSA-N,
MFCD09910206,
1-Benzyl-4-methyl-3-aminomethylpyrrolidine,
B67399,
109416-81-1,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 204.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 204.317g/mol |
| Monoisotopic Mass | 204.163g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number