Diisooctyl dithiophosphate
TL;DR: Diisooctyl dithiophosphate (CAS 26999-29-1) is a chemical compound with molecular formula C16H35O2PS2 and molecular weight 354.1816 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis(6-methylheptoxy)-sulfanyl-sulfanylidene-λ5-phosphane
Also Known As: diisooctyl dithiophosphate, O,O'-Diisoctylphosphorodithioic acid, NCIOpen2_008024, diisooctyldithiophosphoric acid, O,O'-Diisooctyl phosphorodithioic acid
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H35O2PS2 |
| Molecular Weight | 354.1816 g/mol |
| XLogP | 7.9 |
| Topological Polar Surface Area (TPSA) | 51.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 354.1816 Da |
| Heavy Atoms | 21 |
| Complexity | 259.0 |
| SMILES | CC(C)CCCCCOP(=S)(OCCCCCC(C)C)S |
| InChIKey | DXECDJILNIXBML-UHFFFAOYSA-N |
Chemical Property Profile of Diisooctyl dithiophosphate
Property Insights of Diisooctyl dithiophosphate
The XLogP value of 7.9 indicates that Diisooctyl dithiophosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.6 Ų, Diisooctyl dithiophosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diisooctyl dithiophosphate has 1 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 Diisooctyl dithiophosphate?
The CAS number of Diisooctyl dithiophosphate is 26999-29-1.
What is the molecular formula of Diisooctyl dithiophosphate?
The molecular formula of Diisooctyl dithiophosphate is C16H35O2PS2.
What is the molecular weight of Diisooctyl dithiophosphate?
The molecular weight of Diisooctyl dithiophosphate is 354.1816 g/mol.
Where can I buy Diisooctyl dithiophosphate?
You can request a quote for Diisooctyl dithiophosphate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Diisooctyl dithiophosphate?
Yes, CoreyChem provides custom synthesis services for Diisooctyl dithiophosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.