| CAS Number | 1375068-79-3 |
| Catalog Number | AG009WWD(AGN-PC-0WABUE) |
| Chemical Name | 6-Bromo-4,5-difluorobenzimidiazole |
| IUPAC Name | 6-bromo-4,5-difluoro-1H-benzimidazole |
| 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 |
| MDL Number | MFCD22205774 |
| Molecular Formula | C7H3BrF2N2 |
| Molecular Weight | 233.0129 |
| SMILES | Brc1cc2nc[nH]c2c(c1F)F |
| Synonyms | 6-Bromo-4,5-difluorobenzimidiazole,
1375068-79-3,
SCHEMBL16972836,
ZX-RL003620,
KM3907,
MFCD22205774,
ZINC95495612,
FCH3748975,
PC500001,
V2733,
6-BROMO-4,5-DIFLUORO-3H-1,3-BENZODIAZOLE,
C7H3BrF2N2,
|
| Complexity | 181 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 231.945g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 233.016g/mol |
| Monoisotopic Mass | 231.945g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 28.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number