| CAS Number | 1909316-01-3 |
| Catalog Number | AG01C20B |
| Chemical Name | N-[2-(BENZYLAMINO)ETHYL]CYCLOPROPANAMINE DIHYDROCHLORIDE |
| IUPAC Name | N-benzyl-N'-cyclopropylethane-1,2-diamine;dihydrochloride |
| InChI | InChI=1S/C12H18N2.2ClH/c1-2-4-11(5-3-1)10-13-8-9-14-12-6-7-12;;/h1-5,12-14H,6-10H2;2*1H |
| InChI Key | ZGLICBYMOUGDKW-UHFFFAOYSA-N |
| MDL Number | MFCD29054904 |
| Molecular Formula | C12H20Cl2N2 |
| Molecular Weight | 263.2066 |
| SMILES | Cl.Cl.C(NCC1=CC=CC=C1)CNC1CC1 |
| Synonyms | 1909316-01-3,
N-[2-(benzylamino)ethyl]cyclopropanamine dihydrochloride,
Z2255110647,
|
| Complexity | 148 |
| 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 | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 263.206g/mol |
| Monoisotopic Mass | 262.1g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 24.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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