2-[2-(Trifluoromethyl)-1H-1,3-benzodiazol-1-yl]ethan-1-ol

• Catalog: OFC116040983
• CAS: 116040-98-3
• Category: Fluorinated Benzimidazoles
• Synonyms: N-Hydroxyethyl-2-trifluoromethylbenzoimidazole
• MDL Number: MFCD01017153

• IUPAC Name: 2-[2-(trifluoromethyl)benzimidazol-1-yl]ethanol
• InChI: InChI=1S/C10H9F3N2O/c11-10(12,13)9-14-7-3-1-2-4-8(7)15(9)5-6-16/h1-4,16H,5-6H2
• InChI Key: YJDGCKQTFGITHQ-UHFFFAOYSA-N
• Isomeric SMILES: C1=CC=C2C(=C1)N=C(N2CCO)C(F)(F)F

• Molecular Formula: C10H9F3N2O
• Molecular Weight: 230.19

• XLogP3-AA: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 230.06669740 g/mol
• Monoisotopic Mass: 230.06669740 g/mol
• Topological Polar Surface Area: 38Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 247