| CAS Number | 1215295-84-3 |
| Catalog Number | AG009DXA(AGN-PC-0WB5G7) |
| Chemical Name | 4-Ethyl-5-methylpyrimidin-2-ol |
| IUPAC Name | 6-ethyl-5-methyl-1H-pyrimidin-2-one |
| InChI | InChI=1S/C7H10N2O/c1-3-6-5(2)4-8-7(10)9-6/h4H,3H2,1-2H3,(H,8,9,10) |
| InChI Key | MFLKSHVKRZWJRO-UHFFFAOYSA-N |
| MDL Number | MFCD18917004 |
| Molecular Formula | C7H10N2O |
| Molecular Weight | 138.1671 |
| SMILES | N1C(CC)=C(C)C=NC=1O |
| Synonyms | 1215295-84-3,
4-ethyl-5-methyl-2-pyrimidinol,
4-Ethyl-5-methylpyrimidin-2-ol,
6-Ethyl-5-methylpyrimidin-2(1H)-one,
DTXSID20679752,
MFCD14702856,
ZINC42383879,
AKOS006334174,
AKOS022185593,
AJ-104293,
6-ethyl-5-methyl-1,2-dihydropyrimidin-2-one,
6-ETHYL-5-METHYL-2(1H)-PYRIMIDINONE,
Y-7986,
6-ethyl-5-methyl-2(1H)-pyrimidinone(SALTDATA,
|
| Complexity | 216 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 138.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 138.17g/mol |
| Monoisotopic Mass | 138.079g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number