2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methyl-, 1-oxide
TL;DR: 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methyl-, 1-oxide (CAS 1449-89-4) is a chemical compound with molecular formula C5H9O4P and molecular weight 164.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-2,6,7-trioxa-1λ5-phosphabicyclo[2.2.2]octane 1-oxide
Also Known As: Methylbicyclophosphate, Methyl bicyclophosphate, Coumarin 2, 4-methyl-2,6,7-trioxa-1, 4-Methyl-1-oxo-1-phospha-2,6,7-trioxabicyclo(2.2.2)octane
| Molecular Formula | C5H9O4P |
|---|---|
| Molecular Weight | 164.02 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 164.02385 |
| Heavy Atoms | 10 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 1449-89-4 |
|---|---|
| SMILES | CC12COP(=O)(OC1)OC2 |
| InChIKey | SEOXVQTUPVKLTH-UHFFFAOYSA-N |
Product Overview
2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methyl-, 1-oxide (CAS 1449-89-4), with molecular formula C5H9O4P and molecular weight 164.02 g/mol. IUPAC: 4-methyl-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-methyl-, 1-oxide
Property Insights of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methyl-, 1-oxide
The XLogP value of -0.3 indicates that 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methyl-, 1-oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 44.8 Ų, 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methyl-, 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-methyl-, 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
Frequently Asked Questions
What is the CAS number of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methyl-, 1-oxide?
The CAS number of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methyl-, 1-oxide is 1449-89-4.
What is the molecular formula of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methyl-, 1-oxide?
The molecular formula of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methyl-, 1-oxide is C5H9O4P.
What is the molecular weight of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methyl-, 1-oxide?
The molecular weight of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methyl-, 1-oxide is 164.02 g/mol.
Where can I buy 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methyl-, 1-oxide?
You can request a quote for 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methyl-, 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-methyl-, 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methyl-, 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.