Trioctyl phosphate
TL;DR: Trioctyl phosphate (CAS 1806-54-8) is a chemical compound with molecular formula C24H51O4P and molecular weight 434.3525 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trioctyl phosphate
Also Known As: TRIOCTYL PHOSPHATE, Tri-N-octyl phosphate, trioctylphosphate, Phosphoric acid, trioctyl ester, Disflamoll TOF
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C24H51O4P |
| Molecular Weight | 434.3525 g/mol |
| XLogP | 9.8 |
| Topological Polar Surface Area (TPSA) | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 24 |
| Exact Mass | 434.3525 Da |
| Heavy Atoms | 29 |
| Complexity | 310.0 |
| Melting Point | -101 °F (NTP, 1992) |
| Boiling Point | 428 to 446 °F at 8 mmHg (NTP, 1992) |
| Density | 434.63 (NTP, 1992) - Denser than water; will sink |
| Flash Point | greater than 200 °F (NTP, 1992) |
| Solubility | Insoluble (<1 mg/ml) (NTP, 1992) |
| SMILES | CCCCCCCCOP(=O)(OCCCCCCCC)OCCCCCCCC |
| InChIKey | WVPGXJOLGGFBCR-UHFFFAOYSA-N |
Chemical Property Profile of Trioctyl phosphate
Property Insights of Trioctyl phosphate
The XLogP value of 9.8 indicates that Trioctyl phosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, Trioctyl phosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trioctyl phosphate 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 Trioctyl phosphate?
The CAS number of Trioctyl phosphate is 1806-54-8.
What is the molecular formula of Trioctyl phosphate?
The molecular formula of Trioctyl phosphate is C24H51O4P.
What is the molecular weight of Trioctyl phosphate?
The molecular weight of Trioctyl phosphate is 434.3525 g/mol.
Where can I buy Trioctyl phosphate?
You can request a quote for Trioctyl phosphate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Trioctyl phosphate?
Yes, CoreyChem provides custom synthesis services for Trioctyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.