![2-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide structure](/static/products/4778/477871-74-2.webp)
2-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide
TL;DR: 2-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide (CAS 477871-74-2) is a chemical compound with molecular formula C14H14FNO3 and molecular weight 263.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3'-(2-fluorophenyl)-1-oxidospiro[1-azoniabicyclo[2.2.2]octane-2,2'-oxirane]-3-one
Also Known As: 2-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide, 3'-(2-fluorophenyl)-3-oxo-1-azaspiro[bicyclo[2.2.2]octane-2,2'-oxiran]-1-ium-1-olate, 1R-0711, 3'-(2-fluorophenyl)-1-oxidospiro[1-azoniabicyclo[2.2.2]octane-2,2'-oxirane]-3-one, 3-(2-fluorophenyl)-1'-oxido-spiro[oxirane-2,2'-quinuclidin-1-ium]-3'-one
| Molecular Formula | C14H14FNO3 |
|---|---|
| Molecular Weight | 263.10 g/mol |
| LogP | 1.9006 |
| Topological Polar Surface Area | 52.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 263.09576 |
| Heavy Atoms | 19 |
| Complexity | 567.56445 |
Chemical Identifiers
| CAS Number | 477871-74-2 |
|---|---|
| SMILES | C1C[N+]2(CCC1C(=O)C23C(O3)C4=CC=CC=C4F)[O-] |
Product Overview
2-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide (CAS 477871-74-2), with molecular formula C14H14FNO3 and molecular weight 263.10 g/mol. IUPAC: 3'-(2-fluorophenyl)-1-oxidospiro[1-azoniabicyclo[2.2.2]octane-2,2'-oxirane]-3-one.
Chemical Property Profile of 2-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide
Property Insights of 2-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide
The XLogP value of 1.9006 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide. With a topological polar surface area (TPSA) of 52.66 Ų, 2-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide 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-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide?
The CAS number of 2-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide is 477871-74-2.
What is the molecular formula of 2-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide?
The molecular formula of 2-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide is C14H14FNO3.
What is the molecular weight of 2-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide?
The molecular weight of 2-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide is 263.10 g/mol.
Where can I buy 2-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide?
You can request a quote for 2-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-fluorophenyl)(epoxy)methyl]-3-oxo-1-azaniabicyclo[2.2.2]octane N-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.