Catalog | OFC887405223 |
CAS | 887405-22-3 |
Category | Fluorinated Benzimidazoles |
Synonyms | 2-(5-Fluoro-1H-benzimidazol-2-yl)ethylamine |
MDL Number | MFCD06410898 |
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IUPAC Name | 2-(6-fluoro-1H-benzimidazol-2-yl)ethanamine |
InChI | InChI=1S/C9H10FN3/c10-6-1-2-7-8(5-6)13-9(12-7)3-4-11/h1-2,5H,3-4,11H2,(H,12,13) |
InChI Key | DXRBTOABNFRJTK-UHFFFAOYSA-N |
Isomeric SMILES | C1=CC2=C(C=C1F)NC(=N2)CCN |
Molecular Formula | C9H10FN3 |
Molecular Weight | 179.19 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 2 |
Exact Mass | 179.08587549 g/mol |
Monoisotopic Mass | 179.08587549 g/mol |
Topological Polar Surface Area | 54.7Ų |
Heavy Atom Count | 13 |
Formal Charge | 0 |
Complexity | 176 |
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