TL;DR: Erionite (CAS 12510-42-8) is a chemical compound with molecular formula AlCaH60KNaO36Si2+3 and molecular weight 821.1379 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
aluminum;calcium;potassium;sodium;oxido-[oxido(oxo)silyl]oxy-oxosilane;oxygen(2-);triacontahydrate
Also Known As: ERIONITE, Erionita, triacontahydrate, Erionite fiber, Al.Ca.30H2O.K.Na.O5Si2.O
| Molecular Formula | AlCaH60KNaO36Si2+3 |
| Molecular Weight | 821.1379 g/mol |
| XLogP | -35.06 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 30 |
| Hydrogen Bond Acceptors | 36 |
| Rotatable Bonds | 0 |
| Exact Mass | 821.1379 Da |
| Heavy Atoms | 42 |
| Complexity | 71.0 |
| Density | Specific gravity: 2.02 to 2.08 |
| SMILES | O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[O-2].[O-][Si](=O)O[Si](=O)[O-].[Na+].[Al+3].[K+].[Ca+2] |
| InChIKey | AQTSNQQRPNNYRB-UHFFFAOYSA-N |
The XLogP value of -35.06 indicates that Erionite is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Erionite. Following Lipinski's Rule of Five, Erionite has 30 hydrogen bond donor(s) and 36 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Erionite is 12510-42-8.
The molecular formula of Erionite is AlCaH60KNaO36Si2+3.
The molecular weight of Erionite is 821.1379 g/mol.
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