| CAS Number | 1393442-43-7 |
| Catalog Number | AG009WWF(AGN-PC-0WAB7A) |
| Chemical Name | 5-Bromo-6,7-difluoro-1,2-dimethyl-1,3-benzodiazole |
| IUPAC Name | 5-bromo-6,7-difluoro-1,2-dimethylbenzimidazole |
| InChI | InChI=1S/C9H7BrF2N2/c1-4-13-6-3-5(10)7(11)8(12)9(6)14(4)2/h3H,1-2H3 |
| InChI Key | NFTZXGHDKCPZIG-UHFFFAOYSA-N |
| MDL Number | MFCD22383708 |
| Molecular Formula | C9H7BrF2N2 |
| Molecular Weight | 261.0661 |
| SMILES | Brc1cc2nc(n(c2c(c1F)F)C)C |
| Synonyms | 5-BROMO-6,7-DIFLUORO-1,2-DIMETHYL-1,3-BENZODIAZOLE,
1393442-43-7,
KM3913,
ZINC95495618,
V2950,
C9H7BrF2N2,
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| Complexity | 229 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 259.976g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 261.07g/mol |
| Monoisotopic Mass | 259.976g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number