| CAS Number | 89694-98-4 |
| Catalog Number | AG00H28C(AGN-PC-0WCN4V) |
| Chemical Name | N-(4-chloro-6-methylpyrimidin-2-yl)acetamide |
| IUPAC Name | N-(4-chloro-6-methylpyrimidin-2-yl)acetamide |
| InChI | InChI=1S/C7H8ClN3O/c1-4-3-6(8)11-7(9-4)10-5(2)12/h3H,1-2H3,(H,9,10,11,12) |
| InChI Key | YAQVCJUGWWDSKM-UHFFFAOYSA-N |
| MDL Number | MFCD00461610 |
| Molecular Formula | C7H8ClN3O |
| Molecular Weight | 185.6109 |
| SMILES | CC(NC1=NC(Cl)=CC(C)=N1)=O |
| Synonyms | N-(4-chloro-6-methylpyrimidin-2-yl)acetamide,
89694-98-4,
ZINC26948540,
AKOS006343063,
MCULE-6011375840,
L-3705,
F1967-0622,
|
| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 185.036g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 185.611g/mol |
| Monoisotopic Mass | 185.036g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 54.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number