TL;DR: (Diethoxyphosphoryl)(phenyl)methyl acetate (CAS 1621-55-2) is a chemical compound with molecular formula C13H19O5P and molecular weight 286.09702 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[diethoxyphosphoryl(phenyl)methyl] acetate
Also Known As: (diethoxyphosphoryl)(phenyl)methyl acetate, KST-1A1853, (diethoxyphosphoryl)(phenyl)methylacetate, [diethoxyphosphoryl(phenyl)methyl] acetate, J2.003.711C
| Molecular Formula | C13H19O5P |
| Molecular Weight | 286.09702 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 286.09702 Da |
| Heavy Atoms | 19 |
| Complexity | 315.0 |
| SMILES | CCOP(=O)(C(C1=CC=CC=C1)OC(=O)C)OCC |
| InChIKey | WWHXLXPXRXITDS-UHFFFAOYSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Diethoxyphosphoryl)(phenyl)methyl acetate. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (Diethoxyphosphoryl)(phenyl)methyl acetate. Following Lipinski's Rule of Five, (Diethoxyphosphoryl)(phenyl)methyl acetate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (Diethoxyphosphoryl)(phenyl)methyl acetate is 1621-55-2.
The molecular formula of (Diethoxyphosphoryl)(phenyl)methyl acetate is C13H19O5P.
The molecular weight of (Diethoxyphosphoryl)(phenyl)methyl acetate is 286.09702 g/mol.
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