Organofluorine / Alfa Chemistry
2-(Aminomethyl)-5-fluoro-1H-benzimidazole

2-(Aminomethyl)-5-fluoro-1H-benzimidazole

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2-(Aminomethyl)-5-fluoro-1H-benzimidazole
Catalog OFC933707541
CAS 933707-54-1
Category Fluorinated Benzimidazoles
Synonyms (5-Fluoro-1H-benzimidazol-2-yl)methylamine
MDL Number MFCD09038196
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Other Identifiers Chemical Data Computational Chemistry
IUPAC Name (6-fluoro-1H-benzimidazol-2-yl)methanamine
InChI InChI=1S/C8H8FN3/c9-5-1-2-6-7(3-5)12-8(4-10)11-6/h1-3H,4,10H2,(H,11,12)
InChI Key BFKMHHYAXUAKPA-UHFFFAOYSA-N
Isomeric SMILES C1=CC2=C(C=C1F)NC(=N2)CN
Molecular Formula C8H8FN3
Molecular Weight 165.17
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 165.07022543 g/mol
Monoisotopic Mass 165.07022543 g/mol
Topological Polar Surface Area 54.7Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 154

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