TL;DR: Barium hexaboride (CAS 12046-08-1) is a chemical compound with molecular formula B6Ba and molecular weight 203.96107 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
Also Known As: Barium boride, Barium hexaboride, barium; boron, EINECS 234-965-6, Barium Hexaboride (Metals Basis)
| Molecular Formula | B6Ba |
| Molecular Weight | 203.96107 g/mol |
| XLogP | -2.6656 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 203.96107 Da |
| Heavy Atoms | 7 |
| Complexity | 0.0 |
| SMILES | [B].[B].[B].[B].[B].[B].[Ba] |
| InChIKey | DBNPLCUZNLSUCT-UHFFFAOYSA-N |
The XLogP value of -2.6656 indicates that Barium hexaboride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 0.0 Ų, Barium hexaboride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Barium hexaboride 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 Barium hexaboride is 12046-08-1.
The molecular formula of Barium hexaboride is B6Ba.
The molecular weight of Barium hexaboride is 203.96107 g/mol.
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