| CAS Number | 1283108-13-3 |
| Catalog Number | AG018G9X(AGN-PC-0WBQ6U) |
| Chemical Name | 3-Bromo-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyridine |
| IUPAC Name | 5-(5-bromopyridin-3-yl)-3-methyl-1,2,4-oxadiazole |
| InChI | InChI=1S/C8H6BrN3O/c1-5-11-8(13-12-5)6-2-7(9)4-10-3-6/h2-4H,1H3 |
| InChI Key | HJKGVCYLZLWOGD-UHFFFAOYSA-N |
| MDL Number | MFCD21091812 |
| Molecular Formula | C8H6BrN3O |
| Molecular Weight | 240.0567 |
| SMILES | CC1N=C(C2=CC(Br)=CN=C2)ON=1 |
| Synonyms | 3-bromo-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyridine,
1283108-13-3,
F2145-0647,
SCHEMBL4211392,
HJKGVCYLZLWOGD-UHFFFAOYSA-N,
ZINC61957943,
AKOS015957891,
MCULE-1801837279,
DA-12966,
FT-0766598,
L-2901,
3-bromo-5-(3-methyl-1,2,4oxadiazol-5-yl)pyridine,
Pyridine, 3-bromo-5-(3-methyl-1,2,4-oxadiazol-5-yl)-,
|
| Complexity | 181 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 238.969g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.06g/mol |
| Monoisotopic Mass | 238.969g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number