| CAS Number | 1739-60-2 |
| Catalog Number | AG01B263 |
| Chemical Name | 4-Chloro-5-methoxy-6-methylpyrimidine |
| IUPAC Name | 4-chloro-5-methoxy-6-methylpyrimidine |
| InChI | InChI=1S/C6H7ClN2O/c1-4-5(10-2)6(7)9-3-8-4/h3H,1-2H3 |
| InChI Key | GLPABZKUDUPPHN-UHFFFAOYSA-N |
| MDL Number | MFCD24154252 |
| Molecular Formula | C6H7ClN2O |
| Molecular Weight | 158.5856 |
| SMILES | CC1=C(C(=NC=N1)Cl)OC |
| Synonyms | 4-Chloro-5-methoxy-6-methylpyrimidine,
1739-60-2,
SCHEMBL12261633,
AKOS020303958,
ZINC107159253,
|
| Complexity | 112 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 158.025g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 158.585g/mol |
| Monoisotopic Mass | 158.025g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 35A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number