| CAS Number | 58909-71-0 |
| Catalog Number | AG01A9VF(AGN-PC-02UZ4H) |
| Chemical Name | 3-Chloro-1-ethyl-1,2-dihydropyrazin-2-one |
| IUPAC Name | 3-chloro-1-ethylpyrazin-2-one |
| InChI | InChI=1S/C6H7ClN2O/c1-2-9-4-3-8-5(7)6(9)10/h3-4H,2H2,1H3 |
| InChI Key | DOJHQENGHOKCAX-UHFFFAOYSA-N |
| MDL Number | MFCD23701989 |
| Molecular Formula | C6H7ClN2O |
| Molecular Weight | 158.5856 |
| SMILES | CCN1C(=O)C(Cl)=NC=C1 |
| Synonyms | 3-chloro-1-ethyl-1,2-dihydropyrazin-2-one,
3-Chloro-1-ethylpyrazin-2(1H)-one,
58909-71-0,
SCHEMBL11250299,
ZINC90225606,
AKOS026727971,
NE21638,
|
| Complexity | 210 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 158.025g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 158.585g/mol |
| Monoisotopic Mass | 158.025g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 32.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number