| CAS Number | 75825-59-1 |
| Catalog Number | AG00GGA7(AGN-PC-0WD4BD) |
| Chemical Name | methyl 2-methoxypyrimidine-4-carboxylate |
| IUPAC Name | methyl 2-methoxypyrimidine-4-carboxylate |
| InChI | InChI=1S/C7H8N2O3/c1-11-6(10)5-3-4-8-7(9-5)12-2/h3-4H,1-2H3 |
| InChI Key | PVZFDCZDHLLGSY-UHFFFAOYSA-N |
| MDL Number | MFCD18642498 |
| Molecular Formula | C7H8N2O3 |
| Molecular Weight | 168.1500 |
| SMILES | COC(C1=NC(OC)=NC=C1)=O |
| Synonyms | Methyl 2-methoxypyrimidine-4-carboxylate,
75825-59-1,
DTXSID60502914,
ZINC88189401,
AKOS006373948,
AJ-128127,
4-Pyrimidinecarboxylic acid, 2-methoxy-, methyl ester,
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| Complexity | 163 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.053g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.152g/mol |
| Monoisotopic Mass | 168.053g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 61.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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