TL;DR: Pyrophosphoric acid, ethyl triisopropyl ester (CAS 63704-58-5) is a chemical compound with molecular formula C11H26O7P2 and molecular weight 332.1154 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
di(propan-2-yloxy)phosphoryl ethyl propan-2-yl phosphate
Also Known As: Ethyl triisopropyl pyrophosphate, ethyl triisopropyl diphosphate, Ethyl tripropan-2-yl diphosphate, Pyrophosphoric acid, ethyl triisopropyl ester, Ethyl tri(propan-2-yl) diphosphate
| Molecular Formula | C11H26O7P2 |
| Molecular Weight | 332.1154 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 80.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 332.1154 Da |
| Heavy Atoms | 20 |
| Complexity | 354.0 |
| SMILES | CCOP(=O)(OC(C)C)OP(=O)(OC(C)C)OC(C)C |
| InChIKey | AIUIOLZIJLZPNQ-UHFFFAOYSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrophosphoric acid, ethyl triisopropyl ester. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrophosphoric acid, ethyl triisopropyl ester. Following Lipinski's Rule of Five, Pyrophosphoric acid, ethyl triisopropyl ester has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Pyrophosphoric acid, ethyl triisopropyl ester is 63704-58-5.
The molecular formula of Pyrophosphoric acid, ethyl triisopropyl ester is C11H26O7P2.
The molecular weight of Pyrophosphoric acid, ethyl triisopropyl ester is 332.1154 g/mol.
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