| CAS Number | 1241428-31-8 |
| Catalog Number | AG00HHJF(AGN-PC-0WG467) |
| Chemical Name | 6-methoxy-5-(4-methyl-1H-imidazol-1-yl)pyridine-2-carbonitrile |
| IUPAC Name | 6-methoxy-5-(4-methylimidazol-1-yl)pyridine-2-carbonitrile |
| InChI | InChI=1S/C11H10N4O/c1-8-6-15(7-13-8)10-4-3-9(5-12)14-11(10)16-2/h3-4,6-7H,1-2H3 |
| InChI Key | NCIUGYXHXBFGBU-UHFFFAOYSA-N |
| MDL Number | MFCD28992016 |
| Molecular Formula | C11H10N4O |
| Molecular Weight | 214.2233 |
| SMILES | COc1nc(C#N)ccc1n1cnc(c1)C |
| Synonyms | 6-Methoxy-5-(4-methyl-1H-imidazol-1-yl)picolinonitrile,
1241428-31-8,
6-methoxy-5-(4-methyl-1H-imidazol-1-yl)pyridine-2-carbonitrile,
SCHEMBL154790,
NCIUGYXHXBFGBU-UHFFFAOYSA-N,
MFCD28992016,
ZINC113221212,
SS-5156,
CS-0036974,
6-methoxy-5-(4-methylimidazol-1-yl)pyridine-2-carbonitrile,
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| Complexity | 287 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.085g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.228g/mol |
| Monoisotopic Mass | 214.085g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 63.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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Certificate of Analysis
Lot Number