| CAS Number | 39513-55-8 |
| Catalog Number | AG00CLOE(AGN-PC-0RJY69) |
| Chemical Name | 1,3-Dimethyl-2,4-dioxopyrimidine-5-carbohydrazide |
| IUPAC Name | 1,3-dimethyl-2,4-dioxopyrimidine-5-carbohydrazide |
| InChI | InChI=1S/C7H10N4O3/c1-10-3-4(5(12)9-8)6(13)11(2)7(10)14/h3H,8H2,1-2H3,(H,9,12) |
| InChI Key | OMGNZARIYYEAGI-UHFFFAOYSA-N |
| MDL Number | MFCD11934280 |
| Molecular Formula | C7H10N4O3 |
| Molecular Weight | 198.1793 |
| SMILES | CN1C(=O)N(C)C(=O)C(C(NN)=O)=C1 |
| Synonyms | 1,3-Dimethyl-2,4-dioxopyrimidine-5-carbohydrazide,
39513-55-8,
1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbohydrazide,
ACMC-209j60,
CTK8B1608,
DTXSID60576231,
ANW-29110,
MFCD11934280,
ZINC32005316,
AKOS015830578,
CJ-17839,
CS-0036597,
B-9025,
F2163-0122,
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| Complexity | 336 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 198.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 198.182g/mol |
| Monoisotopic Mass | 198.075g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 95.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number