| CAS Number | 105277-11-0 |
| Catalog Number | AG008U8N(AGN-PC-00NTTU) |
| Chemical Name | 6-Methoxy-2-methylnicotinonitrile |
| IUPAC Name | 6-methoxy-2-methylpyridine-3-carbonitrile |
| InChI | InChI=1S/C8H8N2O/c1-6-7(5-9)3-4-8(10-6)11-2/h3-4H,1-2H3 |
| InChI Key | ZDVDVDYVVWUZAP-UHFFFAOYSA-N |
| MDL Number | MFCD16659668 |
| Molecular Formula | C8H8N2O |
| Molecular Weight | 148.1619 |
| SMILES | COC1=NC(C)=C(C=C1)C#N |
| Synonyms | 105277-11-0,
6-Methoxy-2-methylnicotinonitrile,
6-METHOXY-2-METHYLPYRIDINE-3-CARBONITRILE,
2-methoxy-6-methylpyridine-5-carbonitrile,
methyl 6-methoxynicotinonitrile,
SCHEMBL2472542,
DTXSID20548338,
ZDVDVDYVVWUZAP-UHFFFAOYSA-N,
3-Cyano-6-methoxy-2-methylpyridine,
MFCD16659668,
ZINC34142102,
RP01569,
AJ-87142,
2-Methyl-6-methoxypyridine-3-carbonitrile,
6-methoxy-2-methyl-3-pyridinecarbonitrile,
Y6914,
C-2517,
3-Pyridinecarbonitrile,6-methoxy-2-methyl-(9CI),
W-204555,
C8H8N2O,
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| Complexity | 172 |
| 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 | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 148.165g/mol |
| Monoisotopic Mass | 148.064g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 45.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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