2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane-4-amine, 1-oxide
TL;DR: 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane-4-amine, 1-oxide (CAS 60028-03-7) is a chemical compound with molecular formula C4H8NO4P and molecular weight 165.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-oxo-2,6,7-trioxa-1λ5-phosphabicyclo[2.2.2]octan-4-amine
Also Known As: 1-oxo-2,6,7-trioxa-1, 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane-4-amine, 1-oxide, 1,3-Propanediol, 2-amino-2-(hydroxymethyl)-, cyclic phosphate (1:1), 4-Amino-2,6,7-trioxa-1lambda~5~-phosphabicyclo[2.2.2]octan-1-one, RefChem:247896
| Molecular Formula | C4H8NO4P |
|---|---|
| Molecular Weight | 165.02 g/mol |
| LogP | -0.131 |
| Topological Polar Surface Area | 70.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 165.01909 |
| Heavy Atoms | 10 |
| Complexity | 174.15005 |
Chemical Identifiers
| CAS Number | 60028-03-7 |
|---|---|
| SMILES | C1C2(COP(=O)(O1)OC2)N |
Product Overview
2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane-4-amine, 1-oxide (CAS 60028-03-7), with molecular formula C4H8NO4P and molecular weight 165.02 g/mol. IUPAC: 1-oxo-2,6,7-trioxa-1λ5-phosphabicyclo[2.2.2]octan-4-amine.
Chemical Property Profile of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane-4-amine, 1-oxide
Property Insights of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane-4-amine, 1-oxide
The XLogP value of -0.131 indicates that 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane-4-amine, 1-oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 70.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane-4-amine, 1-oxide. Following Lipinski's Rule of Five, 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane-4-amine, 1-oxide has 1 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-amine, 1-oxide?
The CAS number of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane-4-amine, 1-oxide is 60028-03-7.
What is the molecular formula of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane-4-amine, 1-oxide?
The molecular formula of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane-4-amine, 1-oxide is C4H8NO4P.
What is the molecular weight of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane-4-amine, 1-oxide?
The molecular weight of 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane-4-amine, 1-oxide is 165.02 g/mol.
Where can I buy 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane-4-amine, 1-oxide?
You can request a quote for 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane-4-amine, 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-amine, 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane-4-amine, 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.