3-Quinuclidinol, 2-methylene-3-(3,4-xylyl)-, hydrochloride
TL;DR: 3-Quinuclidinol, 2-methylene-3-(3,4-xylyl)-, hydrochloride (CAS 82380-45-8) is a chemical compound with molecular formula C16H22ClNO and molecular weight 279.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,4-dimethylphenyl)-2-methylidene-1-azabicyclo[2.2.2]octan-3-ol;hydrochloride
Also Known As: 2-Methylene-3-(3,4-xylyl)-3-quinuclidinol hydrochloride, 3-Quinuclidinol, 2-methylene-3-(3,4-xylyl)-, hydrochloride, 2-Methylene-3-(3',4'-dimethyl)-3-hydroxyquinuclidine hydrochloride, 1-Azabicyclo(2.2.2)octan-3-ol, 3-(3,4-dimethylphenyl)-2-methylene-, hydrochloride, 3-(3,4-dimethylphenyl)-2-methylidene-1-azabicyclo[2.2.2]octa
| Molecular Formula | C16H22ClNO |
|---|---|
| Molecular Weight | 279.14 g/mol |
| LogP | 3.15214 |
| Topological Polar Surface Area | 23.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 279.13898 |
| Heavy Atoms | 19 |
| Complexity | 505.47043 |
Chemical Identifiers
| CAS Number | 82380-45-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2(C3CCN(C2=C)CC3)O)C.Cl |
Product Overview
3-Quinuclidinol, 2-methylene-3-(3,4-xylyl)-, hydrochloride (CAS 82380-45-8), with molecular formula C16H22ClNO and molecular weight 279.14 g/mol. IUPAC: 3-(3,4-dimethylphenyl)-2-methylidene-1-azabicyclo[2.2.2]octan-3-ol;hydrochloride.
Chemical Property Profile of 3-Quinuclidinol, 2-methylene-3-(3,4-xylyl)-, hydrochloride
Property Insights of 3-Quinuclidinol, 2-methylene-3-(3,4-xylyl)-, hydrochloride
The XLogP value of 3.15214 indicates that 3-Quinuclidinol, 2-methylene-3-(3,4-xylyl)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.47 Ų, 3-Quinuclidinol, 2-methylene-3-(3,4-xylyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Quinuclidinol, 2-methylene-3-(3,4-xylyl)-, 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
Frequently Asked Questions
What is the CAS number of 3-Quinuclidinol, 2-methylene-3-(3,4-xylyl)-, hydrochloride?
The CAS number of 3-Quinuclidinol, 2-methylene-3-(3,4-xylyl)-, hydrochloride is 82380-45-8.
What is the molecular formula of 3-Quinuclidinol, 2-methylene-3-(3,4-xylyl)-, hydrochloride?
The molecular formula of 3-Quinuclidinol, 2-methylene-3-(3,4-xylyl)-, hydrochloride is C16H22ClNO.
What is the molecular weight of 3-Quinuclidinol, 2-methylene-3-(3,4-xylyl)-, hydrochloride?
The molecular weight of 3-Quinuclidinol, 2-methylene-3-(3,4-xylyl)-, hydrochloride is 279.14 g/mol.
Where can I buy 3-Quinuclidinol, 2-methylene-3-(3,4-xylyl)-, hydrochloride?
You can request a quote for 3-Quinuclidinol, 2-methylene-3-(3,4-xylyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Quinuclidinol, 2-methylene-3-(3,4-xylyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3-Quinuclidinol, 2-methylene-3-(3,4-xylyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.