Ditridecyl dodecanedioate
TL;DR: Ditridecyl dodecanedioate (CAS 27742-10-5) is a chemical compound with molecular formula C38H74O4 and molecular weight 594.5587 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ditridecyl dodecanedioate
Also Known As: Ditridecyl dodecanedioate, Dodecanedioic acid ditridecyl ester, 1,12-DITRIDECYL DODECANEDIOATE, Dodecanedioic acid,1,12-ditridecyl ester, EINECS 248-634-9
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C38H74O4 |
| Molecular Weight | 594.5587 g/mol |
| XLogP | 16.1 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 37 |
| Exact Mass | 594.5587 Da |
| Heavy Atoms | 42 |
| Complexity | 499.0 |
| SMILES | CCCCCCCCCCCCCOC(=O)CCCCCCCCCCC(=O)OCCCCCCCCCCCCC |
| InChIKey | XEEGJDISKZUVQO-UHFFFAOYSA-N |
Chemical Property Profile of Ditridecyl dodecanedioate
Property Insights of Ditridecyl dodecanedioate
The XLogP value of 16.1 indicates that Ditridecyl dodecanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Ditridecyl dodecanedioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ditridecyl dodecanedioate 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 Ditridecyl dodecanedioate?
The CAS number of Ditridecyl dodecanedioate is 27742-10-5.
What is the molecular formula of Ditridecyl dodecanedioate?
The molecular formula of Ditridecyl dodecanedioate is C38H74O4.
What is the molecular weight of Ditridecyl dodecanedioate?
The molecular weight of Ditridecyl dodecanedioate is 594.5587 g/mol.
Where can I buy Ditridecyl dodecanedioate?
You can request a quote for Ditridecyl dodecanedioate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ditridecyl dodecanedioate?
Yes, CoreyChem provides custom synthesis services for Ditridecyl dodecanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.