| CAS Number | 1256806-82-2 |
| Catalog Number | AG01C55V |
| Chemical Name | 5-(methylamino)pyridine-2-carbonitrile |
| IUPAC Name | 5-(methylamino)pyridine-2-carbonitrile |
| InChI | InChI=1S/C7H7N3/c1-9-7-3-2-6(4-8)10-5-7/h2-3,5,9H,1H3 |
| InChI Key | WMBBYSJOTOXRPG-UHFFFAOYSA-N |
| MDL Number | MFCD18254767 |
| Molecular Formula | C7H7N3 |
| Molecular Weight | 133.1506 |
| SMILES | CNC1=CN=C(C=C1)C#N |
| Synonyms | 5-(Methylamino)picolinonitrile,
1256806-82-2,
5-(methylamino)pyridine-2-carbonitrile,
SCHEMBL13002895,
MFCD18254767,
ZINC96868787,
AKOS017518507,
AK502581,
DS-19018,
Z2429425663,
|
| Complexity | 146 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 133.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 133.154g/mol |
| Monoisotopic Mass | 133.064g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 48.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
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Certificate of Analysis
Lot Number