| CAS Number | 1261685-10-2 |
| Catalog Number | AG019TO1 |
| Chemical Name | 2-chloro-5-methylpyridine-4-carbonitrile |
| IUPAC Name | 2-chloro-5-methylpyridine-4-carbonitrile |
| InChI | InChI=1S/C7H5ClN2/c1-5-4-10-7(8)2-6(5)3-9/h2,4H,1H3 |
| InChI Key | LKKHBZMDFNANDV-UHFFFAOYSA-N |
| MDL Number | MFCD18415532 |
| Molecular Formula | C7H5ClN2 |
| Molecular Weight | 152.5810 |
| SMILES | N#CC1=C(C)C=NC(Cl)=C1 |
| Synonyms | 2-Chloro-5-methylisonicotinonitrile,
1261685-10-2,
2-chloro-5-methylpyridine-4-carbonitrile,
SCHEMBL19565835,
ZINC238524824,
|
| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 152.014g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 152.581g/mol |
| Monoisotopic Mass | 152.014g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 36.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
Lot Number