| CAS Number | 1100767-04-1 |
| Catalog Number | AG01DXBH |
| Chemical Name | 5-Bromo-4-methyl-2-(trifluoromethyl)pyrimidine |
| IUPAC Name | 5-bromo-4-methyl-2-(trifluoromethyl)pyrimidine |
| InChI | InChI=1S/C6H4BrF3N2/c1-3-4(7)2-11-5(12-3)6(8,9)10/h2H,1H3 |
| InChI Key | LPWIDWXNZMPLDJ-UHFFFAOYSA-N |
| MDL Number | MFCD23133295 |
| Molecular Formula | C6H4BrF3N2 |
| Molecular Weight | 241.0086 |
| SMILES | CC1=C(Br)C=NC(C(F)(F)F)=N1 |
| Synonyms | 5-bromo-4-methyl-2-(trifluoromethyl)pyrimidine,
1100767-04-1,
SCHEMBL3925140,
|
| Complexity | 161 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.951g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.011g/mol |
| Monoisotopic Mass | 239.951g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 25.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number