| CAS Number | 926230-79-7 |
| Catalog Number | AG019VGS(AGN-PC-0WO0Z5) |
| Chemical Name | 7-chloro-5-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine |
| IUPAC Name | 7-chloro-5-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine |
| InChI | InChI=1S/C6H2ClF3N4/c7-4-1-3(6(8,9)10)13-5-11-2-12-14(4)5/h1-2H |
| InChI Key | XIJVOFVFGZWNSZ-UHFFFAOYSA-N |
| MDL Number | MFCD09041875 |
| Molecular Formula | C6H2ClF3N4 |
| Molecular Weight | 222.5551 |
| SMILES | FC(C1=NC2N(N=CN=2)C(Cl)=C1)(F)F |
| Synonyms | 7-chloro-5-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine,
926230-79-7,
AC1Q4JGP,
SCHEMBL18358397,
CTK6G7139,
ZINC21950055,
AKOS000124231,
NE62448,
CS-0091217,
EN300-45199,
F1904-0007,
Z1982493840,
|
| Complexity | 224 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.992g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.555g/mol |
| Monoisotopic Mass | 221.992g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 43.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number