4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.1)heptane
TL;DR: 4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.1)heptane (CAS 61580-09-4) is a chemical compound with molecular formula C4H7O3P and molecular weight 134.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-2,6,7-trioxa-1-phosphabicyclo[2.2.1]heptane
Also Known As: 4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.1)heptane, 4-Methyl-2,6,7-trioxa-1-phosphabicyclo[2.2.1]heptane, J3.062.533A, 4-Methyl-1-phospha-2,6,7-trioxabicyclo[2.2.1]heptane, 2,6,7-Trioxa-1-phosphabicyclo[2.2.1]heptane, 4-methyl-
| Molecular Formula | C4H7O3P |
|---|---|
| Molecular Weight | 134.01 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 134.01328 |
| Heavy Atoms | 8 |
| Complexity | 108.0 |
Chemical Identifiers
| CAS Number | 61580-09-4 |
|---|---|
| SMILES | CC12COP(O1)OC2 |
| InChIKey | XKXKZXYVPZVESK-UHFFFAOYSA-N |
Product Overview
4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.1)heptane (CAS 61580-09-4), with molecular formula C4H7O3P and molecular weight 134.01 g/mol. IUPAC: 4-methyl-2,6,7-trioxa-1-phosphabicyclo[2.2.1]heptane.
Chemical Property Profile of 4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.1)heptane
Property Insights of 4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.1)heptane
The XLogP value of -0.1 indicates that 4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.1)heptane is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 27.7 Ų, 4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.1)heptane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.1)heptane has 0 hydrogen bond donor(s) and 3 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 4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.1)heptane?
The CAS number of 4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.1)heptane is 61580-09-4.
What is the molecular formula of 4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.1)heptane?
The molecular formula of 4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.1)heptane is C4H7O3P.
What is the molecular weight of 4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.1)heptane?
The molecular weight of 4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.1)heptane is 134.01 g/mol.
Where can I buy 4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.1)heptane?
You can request a quote for 4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.1)heptane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.1)heptane?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.1)heptane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.