1-Azabicyclo(2.2.2)octane, 2-((4-(phenylmethoxy)phenyl)methyl)-, hydrochloride
TL;DR: 1-Azabicyclo(2.2.2)octane, 2-((4-(phenylmethoxy)phenyl)methyl)-, hydrochloride (CAS 111897-06-4) is a chemical compound with molecular formula C21H26ClNO and molecular weight 343.1703 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(4-phenylmethoxyphenyl)methyl]-1-azoniabicyclo[2.2.2]octane chloride
Also Known As: 2-(4-Benzyloxybenzyl)quinuclidine hydrochloride, 2-((4-(Phenylmethoxy)phenyl)methyl)-1-azabicyclo(2.2.2)octane hydrochloride, 1-AZABICYCLO(2.2.2)OCTANE, 2-((4-(PHENYLMETHOXY)PHENYL)METHYL)-, HYDROCHLORIDE, 2-[4-(benzyloxy)benzyl]-1-azoniabicyclo[2.2.2]octane chloride, 2-[(4-phenylmethoxyphenyl)methyl]-1-azoniabicyclo[2.2.2]octane chloride
Technical Specifications
| Molecular Formula | C21H26ClNO |
| Molecular Weight | 343.1703 g/mol |
| XLogP | -0.12 |
| Topological Polar Surface Area (TPSA) | 13.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 343.1703 Da |
| Heavy Atoms | 24 |
| Complexity | 349.0 |
| SMILES | C1C[NH+]2CCC1CC2CC3=CC=C(C=C3)OCC4=CC=CC=C4.[Cl-] |
| InChIKey | XQSKKAHWELLGMC-UHFFFAOYSA-N |
Chemical Property Profile of 1-Azabicyclo(2.2.2)octane, 2-((4-(phenylmethoxy)phenyl)methyl)-, hydrochloride
Property Insights of 1-Azabicyclo(2.2.2)octane, 2-((4-(phenylmethoxy)phenyl)methyl)-, hydrochloride
The XLogP value of -0.12 indicates that 1-Azabicyclo(2.2.2)octane, 2-((4-(phenylmethoxy)phenyl)methyl)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 13.7 Ų, 1-Azabicyclo(2.2.2)octane, 2-((4-(phenylmethoxy)phenyl)methyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Azabicyclo(2.2.2)octane, 2-((4-(phenylmethoxy)phenyl)methyl)-, hydrochloride has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Azabicyclo(2.2.2)octane, 2-((4-(phenylmethoxy)phenyl)methyl)-, hydrochloride?
The CAS number of 1-Azabicyclo(2.2.2)octane, 2-((4-(phenylmethoxy)phenyl)methyl)-, hydrochloride is 111897-06-4.
What is the molecular formula of 1-Azabicyclo(2.2.2)octane, 2-((4-(phenylmethoxy)phenyl)methyl)-, hydrochloride?
The molecular formula of 1-Azabicyclo(2.2.2)octane, 2-((4-(phenylmethoxy)phenyl)methyl)-, hydrochloride is C21H26ClNO.
What is the molecular weight of 1-Azabicyclo(2.2.2)octane, 2-((4-(phenylmethoxy)phenyl)methyl)-, hydrochloride?
The molecular weight of 1-Azabicyclo(2.2.2)octane, 2-((4-(phenylmethoxy)phenyl)methyl)-, hydrochloride is 343.1703 g/mol.
Where can I buy 1-Azabicyclo(2.2.2)octane, 2-((4-(phenylmethoxy)phenyl)methyl)-, hydrochloride?
You can request a quote for 1-Azabicyclo(2.2.2)octane, 2-((4-(phenylmethoxy)phenyl)methyl)-, hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Azabicyclo(2.2.2)octane, 2-((4-(phenylmethoxy)phenyl)methyl)-, hydrochloride?
Yes, CoreyChem provides custom synthesis services for 1-Azabicyclo(2.2.2)octane, 2-((4-(phenylmethoxy)phenyl)methyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.