2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-diphenyl-
TL;DR: 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-diphenyl- (CAS 85946-91-4) is a chemical compound with molecular formula C17H16O3 and molecular weight 268.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-diphenyl-2,6,7-trioxabicyclo[2.2.2]octane
Also Known As: 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-diphenyl-, 1,4-diphenyl-2,6,7-trioxabicyclo[2.2.2]octane, 1,4-diphenyl-3,5,8-trioxabicyclo[2.2.2]octane, J1.685.198A, 1,4-Diphenyl-2,7,6-trioxabicyclo[2.2.2]octane
| Molecular Formula | C17H16O3 |
|---|---|
| Molecular Weight | 268.11 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 268.10995 |
| Heavy Atoms | 20 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 85946-91-4 |
|---|---|
| SMILES | C1C2(COC(O1)(OC2)C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | GDNDPSKATQMSNS-UHFFFAOYSA-N |
Product Overview
2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-diphenyl- (CAS 85946-91-4), with molecular formula C17H16O3 and molecular weight 268.11 g/mol. IUPAC: 1,4-diphenyl-2,6,7-trioxabicyclo[2.2.2]octane.
Chemical Property Profile of 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-diphenyl-
Property Insights of 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-diphenyl-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-diphenyl-. With a topological polar surface area (TPSA) of 27.7 Ų, 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-diphenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-diphenyl- 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 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-diphenyl-?
The CAS number of 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-diphenyl- is 85946-91-4.
What is the molecular formula of 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-diphenyl-?
The molecular formula of 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-diphenyl- is C17H16O3.
What is the molecular weight of 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-diphenyl-?
The molecular weight of 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-diphenyl- is 268.11 g/mol.
Where can I buy 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-diphenyl-?
You can request a quote for 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-diphenyl- 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-Trioxabicyclo(2.2.2)octane, 1,4-diphenyl-?
Yes, KEHONG BIO provides custom synthesis services for 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-diphenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.