| CAS Number | 1257211-14-5 |
| Catalog Number | AG01ACJA(AGN-PC-0WO9W9) |
| Chemical Name | 4-Chloro-5-methylpicolinonitrile |
| IUPAC Name | 4-chloro-5-methylpyridine-2-carbonitrile |
| InChI | InChI=1S/C7H5ClN2/c1-5-4-10-6(3-9)2-7(5)8/h2,4H,1H3 |
| InChI Key | QJPSMFISXRMBFQ-UHFFFAOYSA-N |
| MDL Number | MFCD18415536 |
| Molecular Formula | C7H5ClN2 |
| Molecular Weight | 152.5810 |
| SMILES | CC1=C(Cl)C=C(C#N)N=C1 |
| Synonyms | 4-Chloro-5-methylpicolinonitrile,
1257211-14-5,
4-chloro-5-methylpyridine-2-carbonitrile,
2-Pyridinecarbonitrile, 4-chloro-5-methyl-,
SCHEMBL20362403,
ZINC95829715,
AKOS026729259,
NE37150,
|
| 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 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number