| CAS Number | 1797949-27-9 |
| Catalog Number | AG01B16O |
| Chemical Name | ethyl 2-cyclopropyl-4-oxo-1,4-dihydropyrimidine-5-carboxylate hydrochloride |
| IUPAC Name | ethyl 2-cyclopropyl-6-oxo-1H-pyrimidine-5-carboxylate;hydrochloride |
| InChI | InChI=1S/C10H12N2O3.ClH/c1-2-15-10(14)7-5-11-8(6-3-4-6)12-9(7)13;/h5-6H,2-4H2,1H3,(H,11,12,13);1H |
| InChI Key | GEJIBYGZTMOWOL-UHFFFAOYSA-N |
| MDL Number | MFCD27959484 |
| Molecular Formula | C10H13ClN2O3 |
| Molecular Weight | 244.6748 |
| SMILES | Cl.CCOC(C1C(=O)N=C(C2CC2)NC=1)=O |
| Synonyms | ethyl 2-cyclopropyl-4-oxo-1,4-dihydropyrimidine-5-carboxylate hydrochloride,
1797949-27-9,
MCULE-7667432438,
Z1787420992,
|
| Complexity | 367 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.675g/mol |
| Monoisotopic Mass | 244.061g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 67.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number