TL;DR: Phosphinecarboxylic acid, 1,1-diethoxy-, ethyl ester, 1-oxide (CAS 1474-78-8) is a chemical compound with molecular formula C7H15O5P and molecular weight 210.0657 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl diethoxyphosphorylformate
Also Known As: Ethyl diethoxyphosphinylformate, Triethyl phosphonoformate, ethyl (diethoxyphosphoryl)formate, Triethyl carboxyphosphonate, ethyl diethoxyphosphorylformate
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C7H15O5P |
| Molecular Weight | 210.0657 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 210.0657 Da |
| Heavy Atoms | 13 |
| Complexity | 193.0 |
| SMILES | CCOC(=O)P(=O)(OCC)OCC |
| InChIKey | NOJFJZZMRDSOLM-UHFFFAOYSA-N |
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphinecarboxylic acid, 1,1-diethoxy-, ethyl ester, 1-oxide. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphinecarboxylic acid, 1,1-diethoxy-, ethyl ester, 1-oxide. Following Lipinski's Rule of Five, Phosphinecarboxylic acid, 1,1-diethoxy-, ethyl ester, 1-oxide 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 Phosphinecarboxylic acid, 1,1-diethoxy-, ethyl ester, 1-oxide is 1474-78-8.
The molecular formula of Phosphinecarboxylic acid, 1,1-diethoxy-, ethyl ester, 1-oxide is C7H15O5P.
The molecular weight of Phosphinecarboxylic acid, 1,1-diethoxy-, ethyl ester, 1-oxide is 210.0657 g/mol.
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