2-(Trifluoromethyl)-1H-benzo[d]imidazol-5-amine

• Catalog: OFC3671667-2
• CAS: 3671-66-7
• Category: Fluorinated Benzimidazoles
• Synonyms: 5-Amino-2-(trifluoromethyl)benzimidazole
• Purity: >95%
• MDL Number: MFCD01632182

• IUPAC Name: 2-(trifluoromethyl)-3H-benzimidazol-5-amine
• InChI: InChI=1S/C8H6F3N3/c9-8(10,11)7-13-5-2-1-4(12)3-6(5)14-7/h1-3H,12H2,(H,13,14)
• InChI Key: CKEKFQLHCAZGSP-UHFFFAOYSA-N
• Isomeric SMILES: C1=CC2=C(C=C1N)NC(=N2)C(F)(F)F
• EC Number: 625-229-9

• Molecular Formula: C8H6F3N3
• Molecular Weight: 201.15

• XLogP3-AA: 2.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 201.05138169 g/mol
• Monoisotopic Mass: 201.05138169 g/mol
• Topological Polar Surface Area: 54.7Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 218