TL;DR: Diphosphoric(III,V) acid, P(sup V),P(sup V)-diethyl dimethyl ester (CAS 1067-76-1) is a chemical compound with molecular formula C6H16O6P2 and molecular weight 246.0422 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethoxyphosphanyl diethyl phosphate
Also Known As: 4100 Bis HC, dimethoxyphosphanyl diethyl phosphate, DIPHOSPHORIC(III,V) ACID, P(sup V),P(sup V)-DIETHYL DIMETHYL ESTER, Ethyl methyl diphosphate (III,V)((EtO)2P(O)OP(OMe)2), 2-Chloro-N-phenyl-N-(1-phenylethenyl)acetamide
| Molecular Formula | C6H16O6P2 |
| Molecular Weight | 246.0422 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 63.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 246.0422 Da |
| Heavy Atoms | 14 |
| Complexity | 173.0 |
| SMILES | CCOP(=O)(OCC)OP(OC)OC |
| InChIKey | PUYLGTLIKPXPRP-UHFFFAOYSA-N |
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diphosphoric(III,V) acid, P(sup V),P(sup V)-diethyl dimethyl ester. The TPSA of 63.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Diphosphoric(III,V) acid, P(sup V),P(sup V)-diethyl dimethyl ester. Following Lipinski's Rule of Five, Diphosphoric(III,V) acid, P(sup V),P(sup V)-diethyl dimethyl ester has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Diphosphoric(III,V) acid, P(sup V),P(sup V)-diethyl dimethyl ester is 1067-76-1.
The molecular formula of Diphosphoric(III,V) acid, P(sup V),P(sup V)-diethyl dimethyl ester is C6H16O6P2.
The molecular weight of Diphosphoric(III,V) acid, P(sup V),P(sup V)-diethyl dimethyl ester is 246.0422 g/mol.
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