2-Phenyl-5-(pentafluorosulfanyl)-1H-benzoimidazole

• Catalog: OFC1379811956
• CAS: 1379811-95-6
• Category: Fluorinated Benzimidazoles
• Synonyms: pentafluoro-(2-phenyl-3H-benzimidazol-5-yl)-lambda6-sulfane
• MDL Number: MFCD22370126

• IUPAC Name: pentafluoro-(2-phenyl-3H-benzimidazol-5-yl)-lambda6-sulfane
• InChI: InChI=1S/C13H9F5N2S/c14-21(15,16,17,18)10-6-7-11-12(8-10)20-13(19-11)9-4-2-1-3-5-9/h1-8H,(H,19,20)
• InChI Key: CSRDYOJLMUULLL-UHFFFAOYSA-N
• Isomeric SMILES: C1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)S(F)(F)(F)(F)F

• Molecular Formula: C13H9F5N2S
• Molecular Weight: 320.28

• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 320.04066028 g/mol
• Monoisotopic Mass: 320.04066028 g/mol
• Topological Polar Surface Area: 29.7Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 405