| CAS Number | 1905453-18-0 |
| Catalog Number | AG01EOGE(AGN-PC-3H46D8) |
| Chemical Name | NSC232003 |
| IUPAC Name | 5-(N-hydroxy-C-methylcarbonimidoyl)-1H-pyrimidine-2,4-dione |
| InChI | InChI=1S/C6H7N3O3/c1-3(9-12)4-2-7-6(11)8-5(4)10/h2,12H,1H3,(H2,7,8,10,11) |
| InChI Key | UDHCVAJUUVCYHW-UHFFFAOYSA-N |
| MDL Number | MFCD31560476 |
| Molecular Formula | C6H7N3O3 |
| Molecular Weight | 169.1381 |
| SMILES | ONC(C)=C1C(NC(N=C1)=O)=O |
| Synonyms | |
| Complexity | 292 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 169.049g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 169.14g/mol |
| Monoisotopic Mass | 169.049g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 90.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | -0.8 |
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Lot Number