2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-(1,1-dimethylethyl)-, 1-oxide
TL;DR: 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-(1,1-dimethylethyl)-, 1-oxide (CAS 82515-39-7) is a chemical compound with molecular formula C8H15O4P and molecular weight 206.0708 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-tert-butyl-2,6,7-trioxa-1λ5-phosphabicyclo[2.2.2]octane 1-oxide
Also Known As: 3-tert-butyl-2,6,7-trioxa-1, 3-(1,1-Dimethylethyl)-2,6,7-trioxa-1-phosphabicyclo(2.2.2)octane 1-oxide, 1,3-Propanediol, 1-tert-butyl-2-(hydroxymethyl)-, cyclic phosphate (1:1), 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-(1,1-dimethylethyl)-, 1-oxide, 3-tert-Butyl-2,6,7-trioxa-1lambda~5~-phosphabicyclo[2.2.2]octan-1-one
Technical Specifications
| Molecular Formula | C8H15O4P |
| Molecular Weight | 206.0708 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.0708 Da |
| Heavy Atoms | 13 |
| Complexity | 245.0 |
| SMILES | CC(C)(C)C1C2COP(=O)(O1)OC2 |
| InChIKey | SEBYPXGQZJQXHS-UHFFFAOYSA-N |
Chemical Property Profile of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-(1,1-dimethylethyl)-, 1-oxide
Property Insights of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-(1,1-dimethylethyl)-, 1-oxide
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-(1,1-dimethylethyl)-, 1-oxide. With a topological polar surface area (TPSA) of 44.8 Ų, 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-(1,1-dimethylethyl)-, 1-oxide 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-(1,1-dimethylethyl)-, 1-oxide 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-(1,1-dimethylethyl)-, 1-oxide?
The CAS number of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-(1,1-dimethylethyl)-, 1-oxide is 82515-39-7.
What is the molecular formula of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-(1,1-dimethylethyl)-, 1-oxide?
The molecular formula of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-(1,1-dimethylethyl)-, 1-oxide is C8H15O4P.
What is the molecular weight of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-(1,1-dimethylethyl)-, 1-oxide?
The molecular weight of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-(1,1-dimethylethyl)-, 1-oxide is 206.0708 g/mol.
Where can I buy 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-(1,1-dimethylethyl)-, 1-oxide?
You can request a quote for 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-(1,1-dimethylethyl)-, 1-oxide 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-(1,1-dimethylethyl)-, 1-oxide?
Yes, CoreyChem provides custom synthesis services for 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 3-(1,1-dimethylethyl)-, 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.