2-(2-Phenylethyl)-5,6-benzo-2-azabicyclo(2.2.2)octane hydrochloride
TL;DR: 2-(2-Phenylethyl)-5,6-benzo-2-azabicyclo(2.2.2)octane hydrochloride (CAS 63828-84-2) is a chemical compound with molecular formula C19H22ClN and molecular weight 299.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(2-phenylethyl)-9-azatricyclo[6.2.2.02,7]dodeca-2,4,6-triene;hydrochloride
Also Known As: 2-(2-Phenylethyl)-5,6-benzo-2-azabicyclo(2.2.2)octane hydrochloride, 1,2,3,4-Tetrahydro-2-(2-phenylethyl)-1,4-ethanoisoquinoline hydrochloride, 1,4-Ethanoisoquinoline, 1,2,3,4-tetrahydro-2-(2-phenylethyl)-, hydrochloride, 10-(2-Phenylethyl)-1,2,3,4-tetrahydro-1,4-(epiminomethano)naphthalene--hydrogen chloride (1/1), RefChem:1057196
| Molecular Formula | C19H22ClN |
|---|---|
| Molecular Weight | 299.14 g/mol |
| LogP | 4.5852 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.14407 |
| Heavy Atoms | 21 |
| Complexity | 595.52515 |
Chemical Identifiers
| CAS Number | 63828-84-2 |
|---|---|
| SMILES | C1CC2C3=CC=CC=C3C1CN2CCC4=CC=CC=C4.Cl |
Product Overview
2-(2-Phenylethyl)-5,6-benzo-2-azabicyclo(2.2.2)octane hydrochloride (CAS 63828-84-2), with molecular formula C19H22ClN and molecular weight 299.14 g/mol. IUPAC: 9-(2-phenylethyl)-9-azatricyclo[6.2.2.02,7]dodeca-2,4,6-triene;hydrochloride.
Chemical Property Profile of 2-(2-Phenylethyl)-5,6-benzo-2-azabicyclo(2.2.2)octane hydrochloride
Property Insights of 2-(2-Phenylethyl)-5,6-benzo-2-azabicyclo(2.2.2)octane hydrochloride
The XLogP value of 4.5852 indicates that 2-(2-Phenylethyl)-5,6-benzo-2-azabicyclo(2.2.2)octane hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, 2-(2-Phenylethyl)-5,6-benzo-2-azabicyclo(2.2.2)octane hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Phenylethyl)-5,6-benzo-2-azabicyclo(2.2.2)octane hydrochloride has 0 hydrogen bond donor(s) and 1 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-Phenylethyl)-5,6-benzo-2-azabicyclo(2.2.2)octane hydrochloride?
The CAS number of 2-(2-Phenylethyl)-5,6-benzo-2-azabicyclo(2.2.2)octane hydrochloride is 63828-84-2.
What is the molecular formula of 2-(2-Phenylethyl)-5,6-benzo-2-azabicyclo(2.2.2)octane hydrochloride?
The molecular formula of 2-(2-Phenylethyl)-5,6-benzo-2-azabicyclo(2.2.2)octane hydrochloride is C19H22ClN.
What is the molecular weight of 2-(2-Phenylethyl)-5,6-benzo-2-azabicyclo(2.2.2)octane hydrochloride?
The molecular weight of 2-(2-Phenylethyl)-5,6-benzo-2-azabicyclo(2.2.2)octane hydrochloride is 299.14 g/mol.
Where can I buy 2-(2-Phenylethyl)-5,6-benzo-2-azabicyclo(2.2.2)octane hydrochloride?
You can request a quote for 2-(2-Phenylethyl)-5,6-benzo-2-azabicyclo(2.2.2)octane hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Phenylethyl)-5,6-benzo-2-azabicyclo(2.2.2)octane hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Phenylethyl)-5,6-benzo-2-azabicyclo(2.2.2)octane hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.