| CAS Number | 136902-53-9 |
| Catalog Number | AG009GMG(AGN-PC-0NHX85) |
| Chemical Name | 5-Bromo-2-(5-bromothiophen-2-yl)pyridine |
| IUPAC Name | 5-bromo-2-(5-bromothiophen-2-yl)pyridine |
| InChI | InChI=1S/C9H5Br2NS/c10-6-1-2-7(12-5-6)8-3-4-9(11)13-8/h1-5H |
| InChI Key | AZBHJODALOVOSN-UHFFFAOYSA-N |
| MDL Number | MFCD29765747 |
| Molecular Formula | C9H5Br2NS |
| Molecular Weight | 319.0157 |
| SMILES | C1=CC(=NC=C1Br)C2=CC=C(S2)Br |
| Synonyms | 2-Bromo-5-(5-bromo-2-pyridyl)thiophene,
136902-53-9,
5-Bromo-2-(5-bromo-2-thienyl)pyridine,
5-Bromo-2-(5-bromothiophen-2-yl)pyridine,
AKOS030524746,
2-(5-Bromo-2-thienyl)-5-bromopyridine,
B4886,
|
| Complexity | 179 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 318.849g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 319.014g/mol |
| Monoisotopic Mass | 316.851g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
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Certificate of Analysis
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