![3-(2-Chloroethyl)-3-azabicyclo[3.2.2]nonane structure](/static/products/5477/54777-55-8.webp)
3-(2-Chloroethyl)-3-azabicyclo[3.2.2]nonane
TL;DR: 3-(2-Chloroethyl)-3-azabicyclo[3.2.2]nonane (CAS 54777-55-8) is a chemical compound with molecular formula C10H18ClN and molecular weight 187.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chloroethyl)-3-azabicyclo[3.2.2]nonane
Also Known As: 3-(2-chloroethyl)-3-azabicyclo[3.2.2]nonane, 3-Azabicyclo[3.2.2]nonane, 3-(2-chloroethyl)-
| Molecular Formula | C10H18ClN |
|---|---|
| Molecular Weight | 187.11 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.11278 |
| Heavy Atoms | 12 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 54777-55-8 |
|---|---|
| SMILES | C1CC2CCC1CN(C2)CCCl |
| InChIKey | LINLLWKQJXBFQP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(2-Chloroethyl)-3-azabicyclo[3.2.2]nonane (CAS 54777-55-8), with molecular formula C10H18ClN and molecular weight 187.11 g/mol. IUPAC: 3-(2-chloroethyl)-3-azabicyclo[3.2.2]nonane.
Chemical Property Profile of 3-(2-Chloroethyl)-3-azabicyclo[3.2.2]nonane
Property Insights of 3-(2-Chloroethyl)-3-azabicyclo[3.2.2]nonane
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Chloroethyl)-3-azabicyclo[3.2.2]nonane. With a topological polar surface area (TPSA) of 3.2 Ų, 3-(2-Chloroethyl)-3-azabicyclo[3.2.2]nonane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Chloroethyl)-3-azabicyclo[3.2.2]nonane 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 3-(2-Chloroethyl)-3-azabicyclo[3.2.2]nonane?
The CAS number of 3-(2-Chloroethyl)-3-azabicyclo[3.2.2]nonane is 54777-55-8.
What is the molecular formula of 3-(2-Chloroethyl)-3-azabicyclo[3.2.2]nonane?
The molecular formula of 3-(2-Chloroethyl)-3-azabicyclo[3.2.2]nonane is C10H18ClN.
What is the molecular weight of 3-(2-Chloroethyl)-3-azabicyclo[3.2.2]nonane?
The molecular weight of 3-(2-Chloroethyl)-3-azabicyclo[3.2.2]nonane is 187.11 g/mol.
Where can I buy 3-(2-Chloroethyl)-3-azabicyclo[3.2.2]nonane?
You can request a quote for 3-(2-Chloroethyl)-3-azabicyclo[3.2.2]nonane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Chloroethyl)-3-azabicyclo[3.2.2]nonane?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Chloroethyl)-3-azabicyclo[3.2.2]nonane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.