TL;DR: Lithium ionophore VII (CAS 106868-29-5) is a chemical compound with molecular formula C28H57O8P and molecular weight 552.3791 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(6-dodecyl-1,4,8,11-tetraoxacyclotetradec-6-yl)ethyl diethyl phosphate
Also Known As: Lithium ionophore VII, 6-DODECYL(14-CROWN-4)-6-ETHANOL DIETHYLPHOSPHATE, 2-(6-dodecyl-1,4,8,11-tetraoxacyclotetradec-6-yl)ethyl diethyl phosphate, 6-Dodecyl(14-crown-4)-6-ethanol diethyl phosphate, 6-[2-(Diethylphosphonooxy)ethyl]-6-dodecyl-14-crown-4
| Molecular Formula | C28H57O8P |
| Molecular Weight | 552.3791 g/mol |
| XLogP | 6.6 |
| Topological Polar Surface Area (TPSA) | 81.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 19 |
| Exact Mass | 552.3791 Da |
| Heavy Atoms | 37 |
| Complexity | 524.0 |
| SMILES | CCCCCCCCCCCCC1(COCCOCCCOCCOC1)CCOP(=O)(OCC)OCC |
| InChIKey | WTJIVAYXSTYCNI-UHFFFAOYSA-N |
The XLogP value of 6.6 indicates that Lithium ionophore VII is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Lithium ionophore VII. Following Lipinski's Rule of Five, Lithium ionophore VII has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Lithium ionophore VII is 106868-29-5.
The molecular formula of Lithium ionophore VII is C28H57O8P.
The molecular weight of Lithium ionophore VII is 552.3791 g/mol.
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