| CAS Number | 1246763-80-3 |
| Catalog Number | AG009JT4(AGN-PC-0WO69F) |
| Chemical Name | 2-Chloro-5-methylpyrimidin-4-ol |
| IUPAC Name | 2-chloro-5-methyl-1H-pyrimidin-6-one |
| InChI | InChI=1S/C5H5ClN2O/c1-3-2-7-5(6)8-4(3)9/h2H,1H3,(H,7,8,9) |
| InChI Key | MFYWDRCFNRGWGU-UHFFFAOYSA-N |
| MDL Number | MFCD21789373 |
| Molecular Formula | C5H5ClN2O |
| Molecular Weight | 144.5590 |
| SMILES | OC1=NC(Cl)=NC=C1C |
| Synonyms | 2-chloro-5-methylpyrimidin-4-ol,
1246763-80-3,
SCHEMBL11498452,
SCHEMBL18791425,
ZINC85786441,
AKOS017626955,
NE38264,
|
| Complexity | 207 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 144.009g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 144.558g/mol |
| Monoisotopic Mass | 144.009g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 41.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number