Organofluorine / Alfa Chemistry
2-[Bromo(difluoro)methyl]-5-chloro-1H-benzimidazole

2-[Bromo(difluoro)methyl]-5-chloro-1H-benzimidazole

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2-[Bromo(difluoro)methyl]-5-chloro-1H-benzimidazole
Catalog OFC1353778401
CAS 1353778-40-1
Category Fluorinated Benzimidazoles
Synonyms 1H-Benzimidazole, 2-(bromodifluoromethyl)-6-chloro-
MDL Number MFCD31922505
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Other Identifiers Chemical Data Computational Chemistry
IUPAC Name 2-[bromo(difluoro)methyl]-6-chloro-1H-benzimidazole
InChI InChI=1S/C8H4BrClF2N2/c9-8(11,12)7-13-5-2-1-4(10)3-6(5)14-7/h1-3H,(H,13,14)
InChI Key JDDVBFHFHGYLJY-UHFFFAOYSA-N
Isomeric SMILES C1=CC2=C(C=C1Cl)NC(=N2)C(F)(F)Br
Molecular Formula C8H4BrClF2N2
Molecular Weight 281.48
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 279.92144 g/mol
Monoisotopic Mass 279.92144 g/mol
Topological Polar Surface Area 28.7Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 229

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