2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-ethyl-4-propyl-, 1-sulfide
TL;DR: 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-ethyl-4-propyl-, 1-sulfide (CAS 121861-58-3) is a chemical compound with molecular formula C9H17O3PS and molecular weight 236.0636 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-ethyl-4-propyl-1-sulfanylidene-2,6,7-trioxa-1λ5-phosphabicyclo[2.2.2]octane
Also Known As: 3-ethyl-4-propyl-1-sulfanylidene-2,6,7-trioxa-1, 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-ethyl-4-propyl-, 1-sulfide, 3-Ethyl-4-propyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane1-sulfide, 4-Propyl-3-ethyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane-1-sulfide, {3-ethyl-4-propyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octan-1-ium-1-yl}sulfanide
Technical Specifications
| Molecular Formula | C9H17O3PS |
| Molecular Weight | 236.0636 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 59.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.0636 Da |
| Heavy Atoms | 14 |
| Complexity | 257.0 |
| SMILES | CCCC12COP(=S)(OC1)OC2CC |
| InChIKey | OWFFCDUVEQIDNU-UHFFFAOYSA-N |
Chemical Property Profile of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-ethyl-4-propyl-, 1-sulfide
Property Insights of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-ethyl-4-propyl-, 1-sulfide
The XLogP value of 3.3 indicates that 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-ethyl-4-propyl-, 1-sulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.8 Ų, 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-ethyl-4-propyl-, 1-sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-ethyl-4-propyl-, 1-sulfide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-ethyl-4-propyl-, 1-sulfide?
The CAS number of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-ethyl-4-propyl-, 1-sulfide is 121861-58-3.
What is the molecular formula of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-ethyl-4-propyl-, 1-sulfide?
The molecular formula of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-ethyl-4-propyl-, 1-sulfide is C9H17O3PS.
What is the molecular weight of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-ethyl-4-propyl-, 1-sulfide?
The molecular weight of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-ethyl-4-propyl-, 1-sulfide is 236.0636 g/mol.
Where can I buy 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-ethyl-4-propyl-, 1-sulfide?
You can request a quote for 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-ethyl-4-propyl-, 1-sulfide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-ethyl-4-propyl-, 1-sulfide?
Yes, CoreyChem provides custom synthesis services for 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-ethyl-4-propyl-, 1-sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.