| CAS Number | 92741-96-3 |
| Catalog Number | AG01E8XW(AGN-PC-0W11N6) |
| Chemical Name | 3-(4,5,6,7-tetrahydro-1H-1,3-benzodiazol-2-yl)propan-1-amine dihydrochloride |
| IUPAC Name | 3-(4,5,6,7-tetrahydro-1H-benzimidazol-2-yl)propan-1-amine;dihydrochloride |
| InChI | InChI=1S/C10H17N3.2ClH/c11-7-3-6-10-12-8-4-1-2-5-9(8)13-10;;/h1-7,11H2,(H,12,13);2*1H |
| InChI Key | WLBLAQYMXBBYBT-UHFFFAOYSA-N |
| MDL Number | MFCD30539810 |
| Molecular Formula | C10H19Cl2N3 |
| Molecular Weight | 252.1840 |
| SMILES | Cl.Cl.NCCCC1NC2=C(CCCC2)N=1 |
| Synonyms | 3-(4,5,6,7-tetrahydro-1H-1,3-benzodiazol-2-yl)propan-1-amine dihydrochloride,
Z2753056724,
92741-96-3,
|
| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 251.096g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 252.183g/mol |
| Monoisotopic Mass | 251.096g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 54.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number