| CAS Number | 1384428-20-9 |
| Catalog Number | AG019YFD(AGN-PC-0WO6CH) |
| Chemical Name | 1-(2-hydroxyethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid |
| IUPAC Name | 1-(2-hydroxyethyl)-2,4-dioxopyrimidine-5-carboxylic acid |
| InChI | InChI=1S/C7H8N2O5/c10-2-1-9-3-4(6(12)13)5(11)8-7(9)14/h3,10H,1-2H2,(H,12,13)(H,8,11,14) |
| InChI Key | QPRYPGHJYLTYKL-UHFFFAOYSA-N |
| MDL Number | MFCD22056418 |
| Molecular Formula | C7H8N2O5 |
| Molecular Weight | 200.1488 |
| SMILES | OCCN1C(=O)NC(=O)C(C(O)=O)=C1 |
| Synonyms | 1-(2-hydroxyethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid,
1384428-20-9,
QPRYPGHJYLTYKL-UHFFFAOYSA-N,
ZINC74942190,
AKOS026728153,
NE50207,
Z234901827,
1-(2-Hydroxyethyl)-2,4-dioxo-3H-pyrimidine-5-carboxylic acid,
|
| Complexity | 322 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.043g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.15g/mol |
| Monoisotopic Mass | 200.043g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 107A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.2 |
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Certificate of Analysis
Lot Number