2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methoxy-, 1-oxide
TL;DR: 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methoxy-, 1-oxide (CAS 80479-45-4) is a chemical compound with molecular formula C5H9O5P and molecular weight 180.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-2,6,7-trioxa-1λ5-phosphabicyclo[2.2.2]octane 1-oxide
Also Known As: 4-methoxy-2,6,7-trioxa-1, 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methoxy-, 1-oxide, 4-Methoxy-2,6,7-trioxa-1-phosphabicyclo(2.2.2)octane 1-oxide, J2.910.990G, 1,3-Propanediol, 2-(hydroxymethyl)-2-methoxy-, cyclic phosphate (1:1)
| Molecular Formula | C5H9O5P |
|---|---|
| Molecular Weight | 180.02 g/mol |
| LogP | 0.5567 |
| Topological Polar Surface Area | 53.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.01875 |
| Heavy Atoms | 11 |
| Complexity | 183.63411 |
Chemical Identifiers
| CAS Number | 80479-45-4 |
|---|---|
| SMILES | COC12COP(=O)(OC1)OC2 |
Product Overview
2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methoxy-, 1-oxide (CAS 80479-45-4), with molecular formula C5H9O5P and molecular weight 180.02 g/mol. IUPAC: 4-methoxy-2,6,7-trioxa-1λ5-phosphabicyclo[2.2.2]octane 1-oxide.
Chemical Property Profile of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methoxy-, 1-oxide
Property Insights of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methoxy-, 1-oxide
The XLogP value of 0.5567 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methoxy-, 1-oxide. With a topological polar surface area (TPSA) of 53.99 Ų, 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methoxy-, 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, 4-methoxy-, 1-oxide has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methoxy-, 1-oxide?
The CAS number of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methoxy-, 1-oxide is 80479-45-4.
What is the molecular formula of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methoxy-, 1-oxide?
The molecular formula of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methoxy-, 1-oxide is C5H9O5P.
What is the molecular weight of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methoxy-, 1-oxide?
The molecular weight of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methoxy-, 1-oxide is 180.02 g/mol.
Where can I buy 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methoxy-, 1-oxide?
You can request a quote for 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methoxy-, 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methoxy-, 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methoxy-, 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.