| CAS Number | 3122-80-3 |
| Catalog Number | AG019Q9C(AGN-PC-00L6CM) |
| Chemical Name | 4-Chloro-2-(methoxymethyl)-6-methylpyrimidine |
| IUPAC Name | 4-chloro-2-(methoxymethyl)-6-methylpyrimidine |
| InChI | InChI=1S/C7H9ClN2O/c1-5-3-6(8)10-7(9-5)4-11-2/h3H,4H2,1-2H3 |
| InChI Key | LRAIBXGPDUQUBD-UHFFFAOYSA-N |
| MDL Number | MFCD11043806 |
| Molecular Formula | C7H9ClN2O |
| Molecular Weight | 172.6122 |
| SMILES | CC1=CC(Cl)=NC(COC)=N1 |
| Synonyms | 4-chloro-2-(methoxymethyl)-6-methylpyrimidine,
3122-80-3,
SCHEMBL18614528,
ZINC49672154,
AKOS010815880,
NE46452,
EN300-87284,
|
| Complexity | 123 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 172.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 172.612g/mol |
| Monoisotopic Mass | 172.04g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number