| CAS Number | 1696280-39-3 |
| Catalog Number | AG01DYTV |
| Chemical Name | 5-Chloro-6-methoxypyrimidin-4-amine |
| IUPAC Name | 5-chloro-6-methoxypyrimidin-4-amine |
| InChI | InChI=1S/C5H6ClN3O/c1-10-5-3(6)4(7)8-2-9-5/h2H,1H3,(H2,7,8,9) |
| InChI Key | HUCCLULXRQPXGS-UHFFFAOYSA-N |
| MDL Number | MFCD28720294 |
| Molecular Formula | C5H6ClN3O |
| Molecular Weight | 159.5736 |
| SMILES | COC1=C(Cl)C(N)=NC=N1 |
| Synonyms | 5-Chloro-6-methoxypyrimidin-4-amine,
1696280-39-3,
4-Amino-5-chloro-6-methoxypyrimidine,
AKOS027303224,
|
| Complexity | 113 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 159.02g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 159.573g/mol |
| Monoisotopic Mass | 159.02g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 61A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number