| CAS Number | 1909348-67-9 |
| Catalog Number | AG01C3Q7 |
| Chemical Name | 6-(dimethylamino)-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile |
| IUPAC Name | 4-(dimethylamino)-1,3-dimethyl-2,6-dioxopyrimidine-5-carbonitrile |
| InChI | InChI=1S/C9H12N4O2/c1-11(2)7-6(5-10)8(14)13(4)9(15)12(7)3/h1-4H3 |
| InChI Key | PPWGGFJIFPLDSS-UHFFFAOYSA-N |
| MDL Number | MFCD29762844 |
| Molecular Formula | C9H12N4O2 |
| Molecular Weight | 208.2172 |
| SMILES | CN(C1N(C)C(=O)N(C)C(=O)C=1C#N)C |
| Synonyms | 6-(dimethylamino)-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile,
1909348-67-9,
AKOS033851164,
ZINC328579580,
EN300-256484,
Z228661776,
|
| Complexity | 402 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.096g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.221g/mol |
| Monoisotopic Mass | 208.096g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 67.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.3 |
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Certificate of Analysis
Lot Number