| CAS Number | 135292-36-3 |
| Catalog Number | AG01DVWJ |
| Chemical Name | 2-Chloro-4-ethoxy-5-methylpyrimidine |
| IUPAC Name | 2-chloro-4-ethoxy-5-methylpyrimidine |
| InChI | InChI=1S/C7H9ClN2O/c1-3-11-6-5(2)4-9-7(8)10-6/h4H,3H2,1-2H3 |
| InChI Key | YWTFPKAHEHPWST-UHFFFAOYSA-N |
| MDL Number | MFCD21098361 |
| Molecular Formula | C7H9ClN2O |
| Molecular Weight | 172.6122 |
| SMILES | CCOC1=C(C)C=NC(Cl)=N1 |
| Synonyms | 2-Chloro-4-ethoxy-5-methyl-pyrimidine,
135292-36-3,
2-chloro-4-ethoxy-5-methylpyrimidine,
ZINC34402499,
AKOS017626834,
AM92021,
|
| 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 | 2.2 |
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Certificate of Analysis
Lot Number