| CAS Number | 1935264-08-6 |
| Catalog Number | AG01B85R |
| Chemical Name | 5-Bromo-4-fluoro-1-methyl-1H-pyrazole |
| IUPAC Name | 5-bromo-4-fluoro-1-methylpyrazole |
| InChI | InChI=1S/C4H4BrFN2/c1-8-4(5)3(6)2-7-8/h2H,1H3 |
| InChI Key | VVHUJWQVOJTUSP-UHFFFAOYSA-N |
| MDL Number | MFCD31615467 |
| Molecular Formula | C4H4BrFN2 |
| Molecular Weight | 178.9904 |
| SMILES | BrC1=C(C=NN1C)F |
| Synonyms | 5-bromo-4-fluoro-1-methyl-1H-pyrazole,
1935264-08-6,
|
| Complexity | 90.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.954g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.992g/mol |
| Monoisotopic Mass | 177.954g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number