Catalog | OFC2338252-1 |
CAS | 2338-25-2 |
Category | Fluorinated Benzimidazoles |
Synonyms | 1H-Benzimidazole, 5,6-dichloro-2-(trifluoromethyl)- |
Purity | >95% |
MDL Number | MFCD01658509 |
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IUPAC Name | 5,6-dichloro-2-(trifluoromethyl)-1H-benzimidazole |
InChI | InChI=1S/C8H3Cl2F3N2/c9-3-1-5-6(2-4(3)10)15-7(14-5)8(11,12)13/h1-2H,(H,14,15) |
InChI Key | KUMRUFFLHYXFLV-UHFFFAOYSA-N |
Isomeric SMILES | C1=C2C(=CC(=C1Cl)Cl)N=C(N2)C(F)(F)F |
Molecular Formula | C8H3Cl2F3N2 |
Molecular Weight | 255.02 |
XLogP3-AA | 4 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 0 |
Exact Mass | 253.9625380 g/mol |
Monoisotopic Mass | 253.9625380 g/mol |
Topological Polar Surface Area | 28.7Ų |
Heavy Atom Count | 15 |
Formal Charge | 0 |
Complexity | 249 |
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