TL;DR: Zirconium chloride (CAS 10026-11-6) is a chemical compound with molecular formula Cl4Zr and molecular weight 229.7801 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tetrachlorozirconium
Also Known As: Zirconium(IV) chloride, Tetrachlorozirconium, Zirconium chloride, ZIRCONIUM TETRACHLORIDE, ZrCl4
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | Cl4Zr |
| Molecular Weight | 229.7801 g/mol |
| XLogP | 2.76 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 231.77716 Da |
| Heavy Atoms | 5 |
| Complexity | 19.0 |
| Melting Point | None, except under pressure, since it sublimes. (USCG, 1999) |
| Boiling Point | Sublimes 627.8 °F (USCG, 1999) |
| Density | 2.083 at 59 °F (USCG, 1999) - Denser than water; will sink |
| Vapor Pressure | Vapor pressure (solid): 1 Pa at 117 °C; 10 Pa at 146 °C; 100 Pa at 181 °C; 1 kPa at 222 °C; 10 kPa at 272 °C; 100 kPa at 336 °C |
| Solubility | Decomposed by water to form ZrOCl2 and HCl |
| SMILES | Cl[Zr](Cl)(Cl)Cl |
| InChIKey | DUNKXUFBGCUVQW-UHFFFAOYSA-J |
The XLogP value of 2.76 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Zirconium chloride. With a topological polar surface area (TPSA) of 0.0 Ų, Zirconium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Zirconium chloride 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 Zirconium chloride is 10026-11-6.
The molecular formula of Zirconium chloride is Cl4Zr.
The molecular weight of Zirconium chloride is 229.7801 g/mol.
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