| CAS Number | 108244-43-5 |
| Catalog Number | AG01EL5G |
| Chemical Name | 2-chloro-6-ethyl-5-methylpyridine-3-carbonitrile |
| IUPAC Name | 2-chloro-6-ethyl-5-methylpyridine-3-carbonitrile |
| InChI | InChI=1S/C9H9ClN2/c1-3-8-6(2)4-7(5-11)9(10)12-8/h4H,3H2,1-2H3 |
| InChI Key | VKWIYSXXRJDRJA-UHFFFAOYSA-N |
| MDL Number | MFCD10478932 |
| Molecular Formula | C9H9ClN2 |
| Molecular Weight | 180.6342 |
| SMILES | CCC1=C(C)C=C(C#N)C(Cl)=N1 |
| Synonyms | 2-chloro-6-ethyl-5-methylpyridine-3-carbonitrile,
ZINC36631428,
AKOS002301366,
ST50793797,
F3379-0293,
108244-43-5,
|
| Complexity | 196 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 180.635g/mol |
| Monoisotopic Mass | 180.045g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 36.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number