| CAS Number | 954216-36-5 |
| Catalog Number | AG01DWWY |
| Chemical Name | 2-Chloro-4-(2-fluorophenyl)pyrimidine |
| IUPAC Name | 2-chloro-4-(2-fluorophenyl)pyrimidine |
| InChI | InChI=1S/C10H6ClFN2/c11-10-13-6-5-9(14-10)7-3-1-2-4-8(7)12/h1-6H |
| InChI Key | RXRFHCCURMZMJW-UHFFFAOYSA-N |
| MDL Number | MFCD09861530 |
| Molecular Formula | C10H6ClFN2 |
| Molecular Weight | 208.6194 |
| SMILES | FC1=C(C2=NC(Cl)=NC=C2)C=CC=C1 |
| Synonyms | 2-chloro-4-(2-fluorophenyl)pyrimidine,
954216-36-5,
2-Chloro-4-(2-fluoro-phenyl)-pyrimidine,
SCHEMBL2350242,
MFCD09861530,
ZINC38580178,
AKOS015947602,
2-Chloro-4-(2-fluorophenyl)-pyrimidine,
CS-0047001,
|
| Complexity | 191 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.02g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.62g/mol |
| Monoisotopic Mass | 208.02g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 25.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number