| CAS Number | 1884457-49-1 |
| Catalog Number | AG01DTMU |
| Chemical Name | 3-(Bromodifluoromethyl)-5-methyl-1H-pyrazole |
| IUPAC Name | 3-[bromo(difluoro)methyl]-5-methyl-1H-pyrazole |
| InChI | InChI=1S/C5H5BrF2N2/c1-3-2-4(10-9-3)5(6,7)8/h2H,1H3,(H,9,10) |
| InChI Key | CYVPIDIJEGEGCJ-UHFFFAOYSA-N |
| MDL Number | MFCD31801401 |
| Molecular Formula | C5H5BrF2N2 |
| Molecular Weight | 211.0074 |
| SMILES | Cc1cc(n[nH]1)C(F)(F)Br |
| Synonyms | 3-(Bromodifluoromethyl)-5-methyl-1H-pyrazole,
1884457-49-1,
|
| Complexity | 131 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.96g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.01g/mol |
| Monoisotopic Mass | 209.96g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 28.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number