TL;DR: Diselenide, di-3-butynyl (CAS 154414-94-5) is a chemical compound with molecular formula C8H10Se2 and molecular weight 265.9113 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(but-3-ynyldiselanyl)but-1-yne
Also Known As: Diselenide, di-3-butynyl, Dibut-3-ynyl diselenide, Di(3-butynyl) perselenide, Di(but-3-yn-1-yl)diselane, 4-(but-3-ynyldiselanyl)but-1-yne
| Molecular Formula | C8H10Se2 |
| Molecular Weight | 265.9113 g/mol |
| XLogP | 1.193 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 265.9113 Da |
| Heavy Atoms | 10 |
| Complexity | 135.0 |
| SMILES | C#CCC[Se][Se]CCC#C |
| InChIKey | IIUDFYLBRIBAGT-UHFFFAOYSA-N |
The XLogP value of 1.193 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diselenide, di-3-butynyl. With a topological polar surface area (TPSA) of 0.0 Ų, Diselenide, di-3-butynyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diselenide, di-3-butynyl has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Diselenide, di-3-butynyl is 154414-94-5.
The molecular formula of Diselenide, di-3-butynyl is C8H10Se2.
The molecular weight of Diselenide, di-3-butynyl is 265.9113 g/mol.
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