6-Bromo-4,5-difluorobenzimidiazole - CAS 1375068-79-3
Catalog: |
BB071865 |
Product Name: |
6-Bromo-4,5-difluorobenzimidiazole |
CAS: |
1375068-79-3 |
Synonyms: |
6-Bromo-4,5-difluorobenzimidiazole; 6-bromo-4,5-difluoro-1H-benzimidazole; 1H-Benzimidazole, 5-bromo-6,7-difluoro-; 5-Bromo-6,7-difluoro-1H-benzo[d]imidazole |
IUPAC Name: | 6-bromo-4,5-difluoro-1H-benzimidazole |
Description: | 6-Bromo-4,5-difluorobenzimidiazole |
Molecular Weight: | 233.01 |
Molecular Formula: | C7H3BrF2N2 |
Canonical SMILES: | C1=C2C(=C(C(=C1Br)F)F)N=CN2 |
InChI: | InChI=1S/C7H3BrF2N2/c8-3-1-4-7(12-2-11-4)6(10)5(3)9/h1-2H,(H,11,12) |
InChI Key: | OCZVPWYZFGBSLI-UHFFFAOYSA-N |
Complexity: | 181 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 231.94477 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 231.94477 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 28.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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