| CAS Number | 1211406-00-6 |
| Catalog Number | AG019WPO |
| Chemical Name | (3-{[methyl(propan-2-yl)amino]methyl}phenyl)methanamine dihydrochloride |
| IUPAC Name | N-[[3-(aminomethyl)phenyl]methyl]-N-methylpropan-2-amine;dihydrochloride |
| InChI | InChI=1S/C12H20N2.2ClH/c1-10(2)14(3)9-12-6-4-5-11(7-12)8-13;;/h4-7,10H,8-9,13H2,1-3H3;2*1H |
| InChI Key | GSZIOAUKVFNRAW-UHFFFAOYSA-N |
| MDL Number | MFCD12913157 |
| Molecular Formula | C12H22Cl2N2 |
| Molecular Weight | 265.2225 |
| SMILES | Cl.Cl.CC(N(CC1=CC(CN)=CC=C1)C)C |
| Synonyms | (3-{[methyl(propan-2-yl)amino]methyl}phenyl)methanamine dihydrochloride,
1211406-00-6,
AC1Q3A5I,
CTK7E5346,
MCULE-8793196454,
NE15650,
EN300-52752,
Z815264218,
|
| Complexity | 156 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 264.116g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 265.222g/mol |
| Monoisotopic Mass | 264.116g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number