Quinuclidine, 3-amino-, dihydrochloride
TL;DR: Quinuclidine, 3-amino-, dihydrochloride (CAS 169105-01-5) is a chemical compound with molecular formula C7H16Cl2N2 and molecular weight 198.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-azabicyclo[2.2.2]octan-3-amine;dihydrochloride
Also Known As: 3-Aminoquinuclidine dihydrochloride, null, 1-Aminoisoquinoline, 3-Aminoquinuclidine, 3-Aminoquinuclidine 2HCl
| Molecular Formula | C7H16Cl2N2 |
|---|---|
| Molecular Weight | 198.07 g/mol |
| LogP | 0.8829 |
| Topological Polar Surface Area | 29.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 198.06906 |
| Heavy Atoms | 11 |
| Complexity | 105.0 |
Chemical Identifiers
| CAS Number | 169105-01-5 |
|---|---|
| SMILES | C1CN2CCC1C(C2)N.Cl.Cl |
| InChIKey | STZHBULOYDCZET-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Quinuclidine, 3-amino-, dihydrochloride (CAS 169105-01-5), with molecular formula C7H16Cl2N2 and molecular weight 198.07 g/mol. IUPAC: 1-azabicyclo[2.2.2]octan-3-amine;dihydrochloride.
Chemical Property Profile of Quinuclidine, 3-amino-, dihydrochloride
Property Insights of Quinuclidine, 3-amino-, dihydrochloride
The XLogP value of 0.8829 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinuclidine, 3-amino-, dihydrochloride. With a topological polar surface area (TPSA) of 29.3 Ų, Quinuclidine, 3-amino-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinuclidine, 3-amino-, dihydrochloride has 3 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 Quinuclidine, 3-amino-, dihydrochloride?
The CAS number of Quinuclidine, 3-amino-, dihydrochloride is 169105-01-5.
What is the molecular formula of Quinuclidine, 3-amino-, dihydrochloride?
The molecular formula of Quinuclidine, 3-amino-, dihydrochloride is C7H16Cl2N2.
What is the molecular weight of Quinuclidine, 3-amino-, dihydrochloride?
The molecular weight of Quinuclidine, 3-amino-, dihydrochloride is 198.07 g/mol.
Where can I buy Quinuclidine, 3-amino-, dihydrochloride?
You can request a quote for Quinuclidine, 3-amino-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinuclidine, 3-amino-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Quinuclidine, 3-amino-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.