| CAS Number | 1803612-02-3 |
| Catalog Number | AG01B9AA |
| Chemical Name | (1-cyclopropyl-2-methyl-1H-1,3-benzodiazol-5-yl)methanamine dihydrochloride |
| IUPAC Name | (1-cyclopropyl-2-methylbenzimidazol-5-yl)methanamine;dihydrochloride |
| InChI | InChI=1S/C12H15N3.2ClH/c1-8-14-11-6-9(7-13)2-5-12(11)15(8)10-3-4-10;;/h2,5-6,10H,3-4,7,13H2,1H3;2*1H |
| InChI Key | NHSIWNALSUPDEH-UHFFFAOYSA-N |
| MDL Number | MFCD02030564 |
| Molecular Formula | C12H17Cl2N3 |
| Molecular Weight | 274.1895 |
| SMILES | Cl.Cl.CC1N(C2CC2)C2=C(C=C(C=C2)CN)N=1 |
| Synonyms | (1-cyclopropyl-2-methyl-1H-1,3-benzodiazol-5-yl)methanamine dihydrochloride,
1803612-02-3,
Z2028214364,
|
| Complexity | 239 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 273.08g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 274.189g/mol |
| Monoisotopic Mass | 273.08g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number