TL;DR: Triethylene glycol dicaprate (CAS 10024-58-5) is a chemical compound with molecular formula C26H50O6 and molecular weight 458.36075 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(2-decanoyloxyethoxy)ethoxy]ethyl decanoate
Also Known As: PEG3 Didecanoate, Didecanoyltriethylene glycol ester, TRIETHYLENE GLYCOL DICAPRATE, TRIETHYLENE GLYCOL DIDECANOATE, 2-[2-(2-decanoyloxyethoxy)ethoxy]ethyl decanoate
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C26H50O6 |
| Molecular Weight | 458.36075 g/mol |
| XLogP | 7.9 |
| Topological Polar Surface Area (TPSA) | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 27 |
| Exact Mass | 458.36075 Da |
| Heavy Atoms | 32 |
| Complexity | 375.0 |
| SMILES | CCCCCCCCCC(=O)OCCOCCOCCOC(=O)CCCCCCCCC |
| InChIKey | KCNIYOMOUYURBQ-UHFFFAOYSA-N |
The XLogP value of 7.9 indicates that Triethylene glycol dicaprate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Triethylene glycol dicaprate. Following Lipinski's Rule of Five, Triethylene glycol dicaprate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Triethylene glycol dicaprate is 10024-58-5.
The molecular formula of Triethylene glycol dicaprate is C26H50O6.
The molecular weight of Triethylene glycol dicaprate is 458.36075 g/mol.
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