| CAS Number | 1245569-34-9 |
| Catalog Number | AG01AIVU(AGN-PC-0WBUJD) |
| Chemical Name | 3-(1-methyl-1H-1,3-benzodiazol-2-yl)propan-1-amine dihydrochloride |
| IUPAC Name | 3-(1-methylbenzimidazol-2-yl)propan-1-amine;dihydrochloride |
| InChI | InChI=1S/C11H15N3.2ClH/c1-14-10-6-3-2-5-9(10)13-11(14)7-4-8-12;;/h2-3,5-6H,4,7-8,12H2,1H3;2*1H |
| InChI Key | CUGLLFWUOPQCGN-UHFFFAOYSA-N |
| MDL Number | MFCD18483508 |
| Molecular Formula | C11H17Cl2N3 |
| Molecular Weight | 262.1788 |
| SMILES | Cl.Cl.CN1C2=C(C=CC=C2)N=C1CCCN |
| Synonyms | 1245569-34-9,
3-(1-methyl-1H-benzo[d]imidazol-2-yl)propan-1-amine dihydrochloride,
3-(1-methyl-1H-1,3-benzodiazol-2-yl)propan-1-amine dihydrochloride,
F2101-0212,
AKOS025440373,
MCULE-2286289485,
NE20922,
EN300-79173,
Z1268152314,
2-(1-Methyl-1H-benzoimidazol-2-yl)-ethylaminedihydrochloride,
797814-91-6,
|
| Complexity | 183 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 261.08g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 262.178g/mol |
| Monoisotopic Mass | 261.08g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number