TL;DR: 2-Bromopyridine-3,4-dicarbonitrile (CAS 132784-63-5) is a chemical compound with molecular formula C7H2BrN3 and molecular weight 206.9432 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-bromopyridine-3,4-dicarbonitrile
Also Known As: 2-bromopyridine-3,4-dicarbonitrile, 2-bromo-3,4-dicyanopyridine, 3,4-pyridinedicarbonitrile, 2-bromo-, 2-bromo-3,4-pyridinedicarbonitrile, 2-bromo-pyridine-3,4-dicarbonitrile
| Molecular Formula | C7H2BrN3 |
| Molecular Weight | 206.9432 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 60.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 206.9432 Da |
| Heavy Atoms | 11 |
| Complexity | 233.0 |
| SMILES | C1=CN=C(C(=C1C#N)C#N)Br |
| InChIKey | YKBVHRXXLBIYPT-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromopyridine-3,4-dicarbonitrile. The TPSA of 60.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Bromopyridine-3,4-dicarbonitrile. Following Lipinski's Rule of Five, 2-Bromopyridine-3,4-dicarbonitrile has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Bromopyridine-3,4-dicarbonitrile is 132784-63-5.
The molecular formula of 2-Bromopyridine-3,4-dicarbonitrile is C7H2BrN3.
The molecular weight of 2-Bromopyridine-3,4-dicarbonitrile is 206.9432 g/mol.
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