| CAS Number | 1245536-23-5 |
| Catalog Number | AG018B9F(AGN-PC-0WBQ52) |
| Chemical Name | 3-Bromo-5-iodo-4-methylpyridine |
| IUPAC Name | 3-bromo-5-iodo-4-methylpyridine |
| InChI | InChI=1S/C6H5BrIN/c1-4-5(7)2-9-3-6(4)8/h2-3H,1H3 |
| InChI Key | APXVUGOSIOXAOS-UHFFFAOYSA-N |
| MDL Number | MFCD17168222 |
| Molecular Formula | C6H5BrIN |
| Molecular Weight | 297.9191 |
| SMILES | CC1=C(C=NC=C1I)Br |
| Synonyms | 3-bromo-5-iodo-4-methylpyridine,
1245536-23-5,
MFCD17168222,
ZINC57340873,
AKOS024618871,
Y3949,
Q-7424,
F1957-0150,
C6H5BrIN,
|
| Complexity | 99.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 296.865g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 297.921g/mol |
| Monoisotopic Mass | 296.865g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number