TL;DR: Calcium arsorate phosphate (3/1/1) (CAS 109877-61-4) is a chemical compound with molecular formula AsCa3O8P and molecular weight 353.74243 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tricalcium;arsorate;phosphate
Also Known As: Calcium arsenate phosphate, tricalcium arsorate phosphate, Calcium arsorate phosphate (3/1/1), calcium,arsoric acid,hydrogen phosphate
| Molecular Formula | AsCa3O8P |
| Molecular Weight | 353.74243 g/mol |
| XLogP | -8.0336 |
| Topological Polar Surface Area (TPSA) | 173.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 0 |
| Exact Mass | 353.74243 Da |
| Heavy Atoms | 13 |
| Complexity | 73.0 |
| SMILES | [O-]P(=O)([O-])[O-].[O-][As](=O)([O-])[O-].[Ca+2].[Ca+2].[Ca+2] |
| InChIKey | INNHHJAXMJRGBT-UHFFFAOYSA-H |
The XLogP value of -8.0336 indicates that Calcium arsorate phosphate (3/1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 173.0 Ų indicates high polarity, suggesting Calcium arsorate phosphate (3/1/1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Calcium arsorate phosphate (3/1/1) has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Calcium arsorate phosphate (3/1/1) is 109877-61-4.
The molecular formula of Calcium arsorate phosphate (3/1/1) is AsCa3O8P.
The molecular weight of Calcium arsorate phosphate (3/1/1) is 353.74243 g/mol.
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