Catalog | OFC1185660085 |
CAS | 1185660-08-5 |
Category | Fluorinated Benzimidazoles |
Synonyms | [3-(5-fluoro-1H-benzimidazol-2-yl)propyl]amine hydrochloride |
Purity | 97% |
MDL Number | MFCD11841204 |
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IUPAC Name | 3-(6-fluoro-1H-benzimidazol-2-yl)propan-1-amine;hydrochloride |
InChI | InChI=1S/C10H12FN3.ClH/c11-7-3-4-8-9(6-7)14-10(13-8)2-1-5-12;/h3-4,6H,1-2,5,12H2,(H,13,14);1H |
InChI Key | QOCFMCCFTBFEDI-UHFFFAOYSA-N |
Isomeric SMILES | C1=CC2=C(C=C1F)NC(=N2)CCCN.Cl |
Molecular Formula | C10H13ClFN3 |
Molecular Weight | 229.68 |
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 3 |
Exact Mass | 229.0782033 g/mol |
Monoisotopic Mass | 229.0782033 g/mol |
Topological Polar Surface Area | 54.7Ų |
Heavy Atom Count | 15 |
Formal Charge | 0 |
Complexity | 188 |
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