Dioctadecyl adipate
TL;DR: Dioctadecyl adipate (CAS 1119-74-0) is a chemical compound with molecular formula C42H82O4 and molecular weight 650.62134 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dioctadecyl hexanedioate
Also Known As: Dioctadecyl adipate, dioctadecyl hexanedioate, Dioctadecyladiapat, Hexanedioic acid, dioctadecyl ester, Adipic acid, dioctadecyl ester
Application Areas
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C42H82O4 |
| Molecular Weight | 650.62134 g/mol |
| XLogP | 18.3 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 41 |
| Exact Mass | 650.62134 Da |
| Heavy Atoms | 46 |
| Complexity | 552.0 |
| SMILES | CCCCCCCCCCCCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCCCCCCCCCCCC |
| InChIKey | GYFBKUFUJKHFLZ-UHFFFAOYSA-N |
Chemical Property Profile of Dioctadecyl adipate
Property Insights of Dioctadecyl adipate
The XLogP value of 18.3 indicates that Dioctadecyl adipate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Dioctadecyl adipate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dioctadecyl adipate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Dioctadecyl adipate?
The CAS number of Dioctadecyl adipate is 1119-74-0.
What is the molecular formula of Dioctadecyl adipate?
The molecular formula of Dioctadecyl adipate is C42H82O4.
What is the molecular weight of Dioctadecyl adipate?
The molecular weight of Dioctadecyl adipate is 650.62134 g/mol.
Where can I buy Dioctadecyl adipate?
You can request a quote for Dioctadecyl adipate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dioctadecyl adipate?
Yes, CoreyChem provides custom synthesis services for Dioctadecyl adipate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.