| CAS Number | 1816289-02-7 |
| Catalog Number | AG01FS3L(AGN-PC-3H5POK) |
| Chemical Name | 4,6-Dichloro-2-(difluoromethyl)pyrimidine |
| IUPAC Name | 4,6-dichloro-2-(difluoromethyl)pyrimidine |
| InChI | InChI=1S/C5H2Cl2F2N2/c6-2-1-3(7)11-5(10-2)4(8)9/h1,4H |
| InChI Key | KHLZCSAFJCIVRL-UHFFFAOYSA-N |
| MDL Number | MFCD29045042 |
| Molecular Formula | C5H2Cl2F2N2 |
| Molecular Weight | 198.9856 |
| SMILES | FC(C1=NC(Cl)=CC(Cl)=N1)F |
| Synonyms | 4,6-Dichloro-2-(difluoromethyl)pyrimidine,
1816289-02-7,
ZINC307699523,
AK684828,
|
| Complexity | 126 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.95631g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 198.98g/mol |
| Monoisotopic Mass | 197.95631g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 25.8Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number