Catalog | OFC132877271 |
CAS | 132877-27-1 |
Category | Fluorinated Benzimidazoles |
Synonyms | 5-(trifluoromethoxy)-1H-benzo[d]imidazol-2-amine |
Purity | 95% |
MDL Number | MFCD16660393 |
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IUPAC Name | 6-(trifluoromethoxy)-1H-benzimidazol-2-amine |
InChI | InChI=1S/C8H6F3N3O/c9-8(10,11)15-4-1-2-5-6(3-4)14-7(12)13-5/h1-3H,(H3,12,13,14) |
InChI Key | PKVNYLKKHHYCHH-UHFFFAOYSA-N |
Isomeric SMILES | C1=CC2=C(C=C1OC(F)(F)F)NC(=N2)N |
Molecular Formula | C8H6F3N3O |
Molecular Weight | 217.15 |
Storage | Keep in dark place, inert atmosphere, room temperature |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 1 |
Exact Mass | 217.04629631 g/mol |
Monoisotopic Mass | 217.04629631 g/mol |
Topological Polar Surface Area | 63.9Ų |
Heavy Atom Count | 15 |
Formal Charge | 0 |
Complexity | 236 |
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