| CAS Number | 1090835-72-5 |
| Catalog Number | AG01AALW(AGN-PC-0WOAAT) |
| Chemical Name | 2-Chloro-4-(4-fluorophenoxy)pyrimidine |
| IUPAC Name | 2-chloro-4-(4-fluorophenoxy)pyrimidine |
| InChI | InChI=1S/C10H6ClFN2O/c11-10-13-6-5-9(14-10)15-8-3-1-7(12)2-4-8/h1-6H |
| InChI Key | PIGAFNQZHMMICP-UHFFFAOYSA-N |
| MDL Number | MFCD11812088 |
| Molecular Formula | C10H6ClFN2O |
| Molecular Weight | 224.6188 |
| SMILES | FC1=CC=C(OC2=NC(Cl)=NC=C2)C=C1 |
| Synonyms | 2-chloro-4-(4-fluorophenoxy)pyrimidine,
1090835-72-5,
AC1Q4MP9,
SCHEMBL15578281,
PIGAFNQZHMMICP-UHFFFAOYSA-N,
ZINC32908958,
AKOS009154451,
MCULE-7889842206,
NE49910,
EN300-68967,
|
| Complexity | 200 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 224.015g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.619g/mol |
| Monoisotopic Mass | 224.015g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number