| CAS Number | 1392274-42-8 |
| Catalog Number | AG01AOP0(AGN-PC-0WBEKQ) |
| Chemical Name | 4-Bromo-5-fluoro-1,3-dimethyl-1H-pyrazole |
| IUPAC Name | 4-bromo-5-fluoro-1,3-dimethylpyrazole |
| InChI | InChI=1S/C5H6BrFN2/c1-3-4(6)5(7)9(2)8-3/h1-2H3 |
| InChI Key | FQVSCBJYJWWQNS-UHFFFAOYSA-N |
| MDL Number | MFCD24540490 |
| Molecular Formula | C5H6BrFN2 |
| Molecular Weight | 193.0169 |
| SMILES | CC1C(Br)=C(F)N(C)N=1 |
| Synonyms | 4-bromo-5-fluoro-1,3-dimethyl-1H-pyrazole,
1392274-42-8,
SCHEMBL15608631,
FQVSCBJYJWWQNS-UHFFFAOYSA-N,
MFCD24540490,
ZINC95098454,
AKOS024273204,
MCULE-7751966678,
|
| Complexity | 111 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.97g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.019g/mol |
| Monoisotopic Mass | 191.97g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number