| CAS Number | 1398663-06-3 |
| Catalog Number | AG01DMKL |
| Chemical Name | 2-butoxy-4-chloro-5-fluoropyrimidine |
| IUPAC Name | 2-butoxy-4-chloro-5-fluoropyrimidine |
| InChI | InChI=1S/C8H10ClFN2O/c1-2-3-4-13-8-11-5-6(10)7(9)12-8/h5H,2-4H2,1H3 |
| InChI Key | FOPOHOZZPRLBQY-UHFFFAOYSA-N |
| MDL Number | MFCD27991668 |
| Molecular Formula | C8H10ClFN2O |
| Molecular Weight | 204.6292 |
| SMILES | CCCCOC1=NC=C(F)C(Cl)=N1 |
| Synonyms | 2-BUTOXY-4-CHLORO-5-FLUOROPYRIMIDINE,
1398663-06-3,
MFCD27991668,
AS-42765,
|
| Complexity | 150 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 204.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 204.629g/mol |
| Monoisotopic Mass | 204.047g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 35A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number