| CAS Number | 1015599-22-0 |
| Catalog Number | AG019V0B |
| Chemical Name | 1,6-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile |
| IUPAC Name | 1,6-dimethyl-2-oxopyridine-3-carbonitrile |
| InChI | InChI=1S/C8H8N2O/c1-6-3-4-7(5-9)8(11)10(6)2/h3-4H,1-2H3 |
| InChI Key | LWVAFJMWTMYUIA-UHFFFAOYSA-N |
| MDL Number | MFCD10478930 |
| Molecular Formula | C8H8N2O |
| Molecular Weight | 148.1619 |
| SMILES | CC1N(C)C(=O)C(C#N)=CC=1 |
| Synonyms | 1,6-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile,
1015599-22-0,
AC1Q3Y0E,
CTK7C8219,
BBL031739,
STL253078,
ZINC22121632,
AKOS002301344,
MCULE-2809574323,
NE41197,
ST50793792,
EN300-43374,
1,6-dimethyl-2-oxohydropyridine-3-carbonitrile,
F3379-0288,
Z744754620,
1,6-dimethyl-2-oxopyridine-3-carbonitrile,
|
| Complexity | 303 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 148.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 148.165g/mol |
| Monoisotopic Mass | 148.064g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 44.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
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Certificate of Analysis
Lot Number