| CAS Number | 1521372-90-6 |
| Catalog Number | AG01BJQH |
| Chemical Name | 5-bromo-4-chloro-1-methyl-1H-pyrazole |
| IUPAC Name | 5-bromo-4-chloro-1-methylpyrazole |
| InChI | InChI=1S/C4H4BrClN2/c1-8-4(5)3(6)2-7-8/h2H,1H3 |
| InChI Key | HXANFFNOZDWOAR-UHFFFAOYSA-N |
| MDL Number | MFCD22398347 |
| Molecular Formula | C4H4BrClN2 |
| Molecular Weight | 195.4450 |
| SMILES | CN1C(Br)=C(Cl)C=N1 |
| Synonyms | 5-bromo-4-chloro-1-methyl-1H-pyrazole,
1521372-90-6,
|
| Complexity | 90.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.925g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.444g/mol |
| Monoisotopic Mass | 193.925g/mol |
| Rotatable Bond Count | 0 |
| 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