5-Bromo-1-t-butyl-6,7-difluorobenzimidazole - CAS 1375069-11-6
Catalog: |
BB072360 |
Product Name: |
5-Bromo-1-t-butyl-6,7-difluorobenzimidazole |
CAS: |
1375069-11-6 |
Synonyms: |
5-Bromo-1-t-butyl-6,7-difluorobenzimidazole; 5-bromo-1-tert-butyl-6,7-difluorobenzimidazole; 5-Bromo-1-tert-butyl-6,7-difluoro-1H-benzimidazole |
IUPAC Name: | 5-bromo-1-tert-butyl-6,7-difluorobenzimidazole |
Description: | 5-Bromo-1-t-butyl-6,7-difluorobenzimidazole |
Molecular Weight: | 289.12 |
Molecular Formula: | C11H11BrF2N2 |
Canonical SMILES: | CC(C)(C)N1C=NC2=CC(=C(C(=C21)F)F)Br |
InChI: | InChI=1S/C11H11BrF2N2/c1-11(2,3)16-5-15-7-4-6(12)8(13)9(14)10(7)16/h4-5H,1-3H3 |
InChI Key: | HLRTWXIBWGNBKD-UHFFFAOYSA-N |
Complexity: | 269 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 288.00737 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 288.00737 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 17.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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