| CAS Number | 1227578-12-2 |
| Catalog Number | AG01A5JA(AGN-PC-0WO0GD) |
| Chemical Name | 3-Chloro-4-Iodo-2-Methylpyridine |
| IUPAC Name | 3-chloro-4-iodo-2-methylpyridine |
| InChI | InChI=1S/C6H5ClIN/c1-4-6(7)5(8)2-3-9-4/h2-3H,1H3 |
| InChI Key | MYBVOXJAEZQQLR-UHFFFAOYSA-N |
| MDL Number | MFCD16610533 |
| Molecular Formula | C6H5ClIN |
| Molecular Weight | 253.4681 |
| SMILES | ClC=1C(=NC=CC1I)C |
| Synonyms | 3-chloro-4-iodo-2-methylpyridine,
1227578-12-2,
ZINC95347783,
AKOS026726214,
NE34201,
Pyridine, 3-chloro-4-iodo-2-methyl-,
3-Chloro-4-iodo-2-methyl-pyridine,
|
| Complexity | 99.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 252.916g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 253.467g/mol |
| Monoisotopic Mass | 252.916g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number