Organofluorine / Alfa Chemistry
1-(3-Fluorobenzyl)-1H-benzo[d]imidazol-2-amine

1-(3-Fluorobenzyl)-1H-benzo[d]imidazol-2-amine

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1-(3-Fluorobenzyl)-1H-benzo[d]imidazol-2-amine
Catalog OFC99138837
CAS 99138-83-7
Category Fluorinated Benzimidazoles
Synonyms 1-[(3-fluorophenyl)methyl]-1H-benzimidazol-2-amine
Purity 97%
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Other Identifiers Chemical Data Computational Chemistry
IUPAC Name 1-[(3-fluorophenyl)methyl]benzimidazol-2-amine
InChI InChI=1S/C14H12FN3/c15-11-5-3-4-10(8-11)9-18-13-7-2-1-6-12(13)17-14(18)16/h1-8H,9H2,(H2,16,17)
InChI Key IGTREIYZVKUTSY-UHFFFAOYSA-N
Isomeric SMILES C1=CC=C2C(=C1)N=C(N2CC3=CC(=CC=C3)F)N
Molecular Formula C14H12FN3
Molecular Weight 241.27
XLogP3-AA 2.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 241.10152556 g/mol
Monoisotopic Mass 241.10152556 g/mol
Topological Polar Surface Area 43.8Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 286

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