TL;DR: Hexanedioic acid, ester with 2,2'-oxybis(ethanol) (CAS 117197-81-6) is a chemical compound with molecular formula C10H18O6 and molecular weight 234.11034 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-[2-(2-hydroxyethoxy)ethoxy]-6-oxohexanoic acid
Also Known As: Diethylene glycol adipate, Diethyleneglycoladipate, diethyleneglycol adipate, Diethylene glycol monoadipate, AA-DEG (LINEAR)
Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H18O6 |
| Molecular Weight | 234.11034 g/mol |
| XLogP | -0.6 |
| Topological Polar Surface Area (TPSA) | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 234.11034 Da |
| Heavy Atoms | 16 |
| Complexity | 203.0 |
| SMILES | C(CCC(=O)OCCOCCO)CC(=O)O |
| InChIKey | BATDEVCTYREDAX-UHFFFAOYSA-N |
The XLogP value of -0.6 indicates that Hexanedioic acid, ester with 2,2'-oxybis(ethanol) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Hexanedioic acid, ester with 2,2'-oxybis(ethanol). Following Lipinski's Rule of Five, Hexanedioic acid, ester with 2,2'-oxybis(ethanol) has 2 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 Hexanedioic acid, ester with 2,2'-oxybis(ethanol) is 117197-81-6.
The molecular formula of Hexanedioic acid, ester with 2,2'-oxybis(ethanol) is C10H18O6.
The molecular weight of Hexanedioic acid, ester with 2,2'-oxybis(ethanol) is 234.11034 g/mol.
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