TL;DR: Dibutyl 2-(dibutylphosphono) succinate (CAS 10140-81-5) is a chemical compound with molecular formula C20H39O7P and molecular weight 422.24335 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dibutyl 2-dibutoxyphosphorylbutanedioate
Also Known As: Dibutyl 2-(dibutylphosphono) succinate, dibutyl 2-dibutoxyphosphorylbutanedioate, Succinic acid, phosphono-, tetrabutyl ester, 2-(Dibutylphosphono)succinic acid, dibutyl ester, 2-(Dibutoxyphosphinyl)succinic acid dibutyl ester
| Molecular Formula | C20H39O7P |
| Molecular Weight | 422.24335 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 88.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 20 |
| Exact Mass | 422.24335 Da |
| Heavy Atoms | 28 |
| Complexity | 453.0 |
| SMILES | CCCCOC(=O)CC(C(=O)OCCCC)P(=O)(OCCCC)OCCCC |
| InChIKey | GGOVRPUILUBRCW-UHFFFAOYSA-N |
The XLogP value of 4.3 indicates that Dibutyl 2-(dibutylphosphono) succinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Dibutyl 2-(dibutylphosphono) succinate. Following Lipinski's Rule of Five, Dibutyl 2-(dibutylphosphono) succinate 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 Dibutyl 2-(dibutylphosphono) succinate is 10140-81-5.
The molecular formula of Dibutyl 2-(dibutylphosphono) succinate is C20H39O7P.
The molecular weight of Dibutyl 2-(dibutylphosphono) succinate is 422.24335 g/mol.
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