TL;DR: Diethyl 2-(diethoxymethyl)-3-formylsuccinate (CAS 73926-95-1) is a chemical compound with molecular formula C14H24O7 and molecular weight 304.1522 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diethyl 2-(diethoxymethyl)-3-formylbutanedioate
Also Known As: Butanedioic acid, diethyl ester, diethyl 2-(diethoxymethyl)-3-formylbutanedioate, Diethyl 2,3-diformylsuccinate mono(diethylacetal), 2- -3-formylbutanedioicaciddiethylester, Diethyl 2-(diethoxymethyl)-3-formylsuccinate
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C14H24O7 |
| Molecular Weight | 304.1522 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 88.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 13 |
| Exact Mass | 304.1522 Da |
| Heavy Atoms | 21 |
| Complexity | 323.0 |
| SMILES | CCOC(C(C(C=O)C(=O)OCC)C(=O)OCC)OCC |
| InChIKey | VWMWTNGQVQUUPC-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 2-(diethoxymethyl)-3-formylsuccinate. The TPSA of 88.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2-(diethoxymethyl)-3-formylsuccinate. Following Lipinski's Rule of Five, Diethyl 2-(diethoxymethyl)-3-formylsuccinate 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 Diethyl 2-(diethoxymethyl)-3-formylsuccinate is 73926-95-1.
The molecular formula of Diethyl 2-(diethoxymethyl)-3-formylsuccinate is C14H24O7.
The molecular weight of Diethyl 2-(diethoxymethyl)-3-formylsuccinate is 304.1522 g/mol.
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