2,6-Dichloro-9-thiabicyclo(3.3.1)nonane
TL;DR: 2,6-Dichloro-9-thiabicyclo(3.3.1)nonane (CAS 6522-21-0) is a chemical compound with molecular formula C8H12Cl2S and molecular weight 210.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dichloro-9-thiabicyclo[3.3.1]nonane
Also Known As: 2,6-Dichloro-9-thiabicyclo[3.3.1]nonane, ClC1CCC2SC1CCC2Cl, 2,6-Dichloro-9-thiabicyclo(3.3.1)nonane, 2,6-Dichloro-9-thiabicyclo nonane, 9-Thiabicyclo(3.3.1)nonane, 2,6-dichloro-
| Molecular Formula | C8H12Cl2S |
|---|---|
| Molecular Weight | 210.00 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 210.00368 |
| Heavy Atoms | 11 |
| Complexity | 135.0 |
Chemical Identifiers
| CAS Number | 6522-21-0 |
|---|---|
| SMILES | C1CC(C2CCC(C1S2)Cl)Cl |
| InChIKey | QUZIEYDEASXPSN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,6-Dichloro-9-thiabicyclo(3.3.1)nonane (CAS 6522-21-0), with molecular formula C8H12Cl2S and molecular weight 210.00 g/mol. IUPAC: 2,6-dichloro-9-thiabicyclo[3.3.1]nonane.
Chemical Property Profile of 2,6-Dichloro-9-thiabicyclo(3.3.1)nonane
Property Insights of 2,6-Dichloro-9-thiabicyclo(3.3.1)nonane
The XLogP value of 3.3 indicates that 2,6-Dichloro-9-thiabicyclo(3.3.1)nonane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, 2,6-Dichloro-9-thiabicyclo(3.3.1)nonane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dichloro-9-thiabicyclo(3.3.1)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 2,6-Dichloro-9-thiabicyclo(3.3.1)nonane?
The CAS number of 2,6-Dichloro-9-thiabicyclo(3.3.1)nonane is 6522-21-0.
What is the molecular formula of 2,6-Dichloro-9-thiabicyclo(3.3.1)nonane?
The molecular formula of 2,6-Dichloro-9-thiabicyclo(3.3.1)nonane is C8H12Cl2S.
What is the molecular weight of 2,6-Dichloro-9-thiabicyclo(3.3.1)nonane?
The molecular weight of 2,6-Dichloro-9-thiabicyclo(3.3.1)nonane is 210.00 g/mol.
Where can I buy 2,6-Dichloro-9-thiabicyclo(3.3.1)nonane?
You can request a quote for 2,6-Dichloro-9-thiabicyclo(3.3.1)nonane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dichloro-9-thiabicyclo(3.3.1)nonane?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dichloro-9-thiabicyclo(3.3.1)nonane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.