Hexanedioic acid, mixed esters with C10-rich C9-11-isoalcs. and pentaerythritol
TL;DR: Hexanedioic acid, mixed esters with C10-rich C9-11-isoalcs. and pentaerythritol (CAS 115984-51-5) is a chemical compound with molecular formula C21H40O9 and molecular weight 436.26724 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-O-[(8S)-9-hydroxy-8-methylnonyl] 6-O-[(1S,2R,3R,4R)-1,2,3,4-tetrahydroxypentyl] hexanedioate
Also Known As: Hexanedioic acid, mixed esters with C10-rich C9-11-isoalcs. and pentaerythritol, 1-O-[(8S)-9-hydroxy-8-methylnonyl] 6-O-[(1S,2R,3R,4R)-1,2,3,4-tetrahydroxypentyl] hexanedioate
Technical Specifications
| Molecular Formula | C21H40O9 |
| Molecular Weight | 436.26724 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 154.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 20 |
| Exact Mass | 436.26724 Da |
| Heavy Atoms | 30 |
| Complexity | 458.0 |
| SMILES | C[C@@H](CCCCCCCOC(=O)CCCCC(=O)O[C@@H]([C@@H]([C@@H]([C@@H](C)O)O)O)O)CO |
| InChIKey | FFZJWGDSUFBPRE-ADDNLYQESA-N |
Chemical Property Profile of Hexanedioic acid, mixed esters with C10-rich C9-11-isoalcs. and pentaerythritol
Property Insights of Hexanedioic acid, mixed esters with C10-rich C9-11-isoalcs. and pentaerythritol
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexanedioic acid, mixed esters with C10-rich C9-11-isoalcs. and pentaerythritol. The TPSA of 154.0 Ų indicates high polarity, suggesting Hexanedioic acid, mixed esters with C10-rich C9-11-isoalcs. and pentaerythritol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Hexanedioic acid, mixed esters with C10-rich C9-11-isoalcs. and pentaerythritol has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Hexanedioic acid, mixed esters with C10-rich C9-11-isoalcs. and pentaerythritol?
The CAS number of Hexanedioic acid, mixed esters with C10-rich C9-11-isoalcs. and pentaerythritol is 115984-51-5.
What is the molecular formula of Hexanedioic acid, mixed esters with C10-rich C9-11-isoalcs. and pentaerythritol?
The molecular formula of Hexanedioic acid, mixed esters with C10-rich C9-11-isoalcs. and pentaerythritol is C21H40O9.
What is the molecular weight of Hexanedioic acid, mixed esters with C10-rich C9-11-isoalcs. and pentaerythritol?
The molecular weight of Hexanedioic acid, mixed esters with C10-rich C9-11-isoalcs. and pentaerythritol is 436.26724 g/mol.
Where can I buy Hexanedioic acid, mixed esters with C10-rich C9-11-isoalcs. and pentaerythritol?
You can request a quote for Hexanedioic acid, mixed esters with C10-rich C9-11-isoalcs. and pentaerythritol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Hexanedioic acid, mixed esters with C10-rich C9-11-isoalcs. and pentaerythritol?
Yes, CoreyChem provides custom synthesis services for Hexanedioic acid, mixed esters with C10-rich C9-11-isoalcs. and pentaerythritol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.