| CAS Number | 944902-19-6 |
| Catalog Number | AG00JSGZ(AGN-PC-03EI24) |
| Chemical Name | 5-(Chloromethyl)-2-methoxypyrimidine |
| IUPAC Name | 5-(chloromethyl)-2-methoxypyrimidine |
| InChI | InChI=1S/C6H7ClN2O/c1-10-6-8-3-5(2-7)4-9-6/h3-4H,2H2,1H3 |
| InChI Key | DQFAKCZQDNAAJI-UHFFFAOYSA-N |
| MDL Number | MFCD10697063 |
| Molecular Formula | C6H7ClN2O |
| Molecular Weight | 158.5856 |
| SMILES | COC1=NC=C(CCl)C=N1 |
| Synonyms | 5-(CHLOROMETHYL)-2-METHOXYPYRIMIDINE,
944902-19-6,
SCHEMBL2308430,
5-Chloromethyl-2-methoxypyrimidin,
DQFAKCZQDNAAJI-UHFFFAOYSA-N,
ZINC88189334,
AKOS006303884,
AB58903,
2-methoxy-5-pyrimidinylmethyl chloride,
|
| Complexity | 93.7 |
| 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 | 2 |
| Topological Polar Surface Area | 35A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number