Organofluorine / Alfa Chemistry
1,2,3-Trimethyl-3H-benzo[d]imidazol-1-ium tetrafluoroborate

1,2,3-Trimethyl-3H-benzo[d]imidazol-1-ium tetrafluoroborate

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1,2,3-Trimethyl-3H-benzo[d]imidazol-1-ium tetrafluoroborate
Catalog OFC98816503
CAS 98816-50-3
Category Fluorinated Benzimidazoles
Synonyms 1,2,3-trimethyl-1H-benzo[d]imidazol-3-ium tetrafluoroborate
MDL Number MFCD00830322
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Other Identifiers Chemical Data Computational Chemistry
IUPAC Name 1,2,3-trimethylbenzimidazol-3-ium;tetrafluoroborate
InChI InChI=1S/C10H13N2.BF4/c1-8-11(2)9-6-4-5-7-10(9)12(8)3;2-1(3,4)5/h4-7H,1-3H3;/q+1;-1
InChI Key RRIWFHDNUFRYQY-UHFFFAOYSA-N
Isomeric SMILES [B-](F)(F)(F)F.CC1=[N+](C2=CC=CC=C2N1C)C
Molecular Formula C10H13BF4N2
Molecular Weight 248.03
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 0
Exact Mass 248.1107912 g/mol
Monoisotopic Mass 248.1107912 g/mol
Topological Polar Surface Area 8.8Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 170

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