![9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide structure](/static/products/6591/65913-90-8.webp)
9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide
TL;DR: 9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide (CAS 65913-90-8) is a chemical compound with molecular formula C8H14O2S and molecular weight 174.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9λ6-thiabicyclo[3.3.1]nonane 9,9-dioxide
Also Known As: 9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide, 9-Thiabicyclo[3.3.1]nonane,9-dioxide, 9-Thiabicyclo<3.3.1>nonan-9,9-dioxid, 9-thiabicyclo[3.3.1]nonane 9,9-dioxide, 9-Thiabicyclo(3.3.1)nonane, 9,9-dioxide
| Molecular Formula | C8H14O2S |
|---|---|
| Molecular Weight | 174.07 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 174.07146 |
| Heavy Atoms | 11 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 65913-90-8 |
|---|---|
| SMILES | C1CC2CCCC(C1)S2(=O)=O |
| InChIKey | ZGPMRVKNTCKLBF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide (CAS 65913-90-8), with molecular formula C8H14O2S and molecular weight 174.07 g/mol. IUPAC: 9λ6-thiabicyclo[3.3.1]nonane 9,9-dioxide.
Chemical Property Profile of 9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide
Property Insights of 9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide. With a topological polar surface area (TPSA) of 42.5 Ų, 9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide has 0 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 9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide?
The CAS number of 9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide is 65913-90-8.
What is the molecular formula of 9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide?
The molecular formula of 9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide is C8H14O2S.
What is the molecular weight of 9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide?
The molecular weight of 9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide is 174.07 g/mol.
Where can I buy 9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide?
You can request a quote for 9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 9-Thiabicyclo[3.3.1]nonane, 9,9-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.