| CAS Number | 1799807-10-5 |
| Catalog Number | AG01FR0W(AGN-PC-3H5PCJ) |
| Chemical Name | 5-Methyl-6-oxo-1,6-dihydro-pyridine-2-carbonitrile |
| IUPAC Name | 5-methyl-6-oxo-1H-pyridine-2-carbonitrile |
| InChI | InChI=1S/C7H6N2O/c1-5-2-3-6(4-8)9-7(5)10/h2-3H,1H3,(H,9,10) |
| InChI Key | RLIBWIBETIALEZ-UHFFFAOYSA-N |
| MDL Number | MFCD30723570 |
| Molecular Formula | C7H6N2O |
| Molecular Weight | 134.1353 |
| SMILES | |
| Synonyms | SCHEMBL16834623,
6-Hydroxy-5-methylpicolinonitrile,
1799807-10-5,
|
| Complexity | 277 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 134.048013g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 134.14g/mol |
| Monoisotopic Mass | 134.048013g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 52.9Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
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Certificate of Analysis
Lot Number