![1-Chlorobicyclo[2.1.1]hexane structure](/static/products/2290/22907-75-1.webp)
1-Chlorobicyclo[2.1.1]hexane
TL;DR: 1-Chlorobicyclo[2.1.1]hexane (CAS 22907-75-1) is a chemical compound with molecular formula C6H9Cl and molecular weight 116.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chlorobicyclo[2.1.1]hexane
Also Known As: 1-chlorobicyclo[2.1.1]hexane, 4-chlorobicyclo[2.1.1]hexane, 1-chloro-bicyclo[2.1.1]hexane, Bicyclo[2.1.1]hexane, 1-chloro-, InChI=1/C6H9Cl/c7-6-2-1-5(3-6)4-6/h5H,1-4H
| Molecular Formula | C6H9Cl |
|---|---|
| Molecular Weight | 116.04 g/mol |
| LogP | 2.1678 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 116.039276 |
| Heavy Atoms | 7 |
| Complexity | 86.84337 |
Chemical Identifiers
| CAS Number | 22907-75-1 |
|---|---|
| SMILES | C1CC2(CC1C2)Cl |
Product Overview
1-Chlorobicyclo[2.1.1]hexane (CAS 22907-75-1), with molecular formula C6H9Cl and molecular weight 116.04 g/mol. IUPAC: 1-chlorobicyclo[2.1.1]hexane.
Chemical Property Profile of 1-Chlorobicyclo[2.1.1]hexane
Property Insights of 1-Chlorobicyclo[2.1.1]hexane
The XLogP value of 2.1678 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Chlorobicyclo[2.1.1]hexane. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Chlorobicyclo[2.1.1]hexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chlorobicyclo[2.1.1]hexane has 0 hydrogen bond donor(s) and 0 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 1-Chlorobicyclo[2.1.1]hexane?
The CAS number of 1-Chlorobicyclo[2.1.1]hexane is 22907-75-1.
What is the molecular formula of 1-Chlorobicyclo[2.1.1]hexane?
The molecular formula of 1-Chlorobicyclo[2.1.1]hexane is C6H9Cl.
What is the molecular weight of 1-Chlorobicyclo[2.1.1]hexane?
The molecular weight of 1-Chlorobicyclo[2.1.1]hexane is 116.04 g/mol.
Where can I buy 1-Chlorobicyclo[2.1.1]hexane?
You can request a quote for 1-Chlorobicyclo[2.1.1]hexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chlorobicyclo[2.1.1]hexane?
Yes, KEHONG BIO provides custom synthesis services for 1-Chlorobicyclo[2.1.1]hexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.