| CAS Number | 1184679-06-8 |
| Catalog Number | AG019Y9N(AGN-PC-0WOCUN) |
| Chemical Name | 4-bromo-1-[(2,3-difluorophenyl)methyl]-1H-pyrazole |
| IUPAC Name | 4-bromo-1-[(2,3-difluorophenyl)methyl]pyrazole |
| InChI | InChI=1S/C10H7BrF2N2/c11-8-4-14-15(6-8)5-7-2-1-3-9(12)10(7)13/h1-4,6H,5H2 |
| InChI Key | WPIGGXVZAHNDSX-UHFFFAOYSA-N |
| MDL Number | MFCD12780065 |
| Molecular Formula | C10H7BrF2N2 |
| Molecular Weight | 273.0768 |
| SMILES | FC1=C(F)C(CN2N=CC(Br)=C2)=CC=C1 |
| Synonyms | 4-bromo-1-[(2,3-difluorophenyl)methyl]-1H-pyrazole,
1184679-06-8,
ZINC38074857,
AKOS006150074,
MCULE-7984427895,
NE29863,
Z839706372,
|
| Complexity | 218 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 271.976g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 273.081g/mol |
| Monoisotopic Mass | 271.976g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number