| CAS Number | 1216310-31-4 |
| Catalog Number | AG01DYIX |
| Chemical Name | 4-bromo-1-(difluoromethyl)-1H-imidazole |
| IUPAC Name | 4-bromo-1-(difluoromethyl)imidazole |
| InChI | InChI=1S/C4H3BrF2N2/c5-3-1-9(2-8-3)4(6)7/h1-2,4H |
| InChI Key | BIZYMGHNRLSEAQ-UHFFFAOYSA-N |
| MDL Number | MFCD13188366 |
| Molecular Formula | C4H3BrF2N2 |
| Molecular Weight | 196.9808 |
| SMILES | FC(N1C=C(Br)N=C1)F |
| Synonyms | 4-bromo-1-(difluoromethyl)-1H-imidazole,
1216310-31-4,
SCHEMBL17102314,
BIZYMGHNRLSEAQ-UHFFFAOYSA-N,
4-bromo-1-(difluoromethyl) imidazole,
|
| Complexity | 101 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.945g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.983g/mol |
| Monoisotopic Mass | 195.945g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number