三环癸烷-9-基黄原酸酯（外消旋）
TL;DR: 三环癸烷-9-基黄原酸酯（外消旋） (CAS 83373-60-8) is a chemical compound with molecular formula C11H16OS2 and molecular weight 228.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三环癸烷-9-基黄原酸酯（外消旋）
8-tricyclo[5.2.1.02,6]decanyloxymethanedithioic acid
Also Known As: D-609 potassium, D609 potassium salt, [?]yloxymethanedithioic acid, Lopac0_001242, BCBcMAP01_000222
| Molecular Formula | C11H16OS2 |
|---|---|
| Molecular Weight | 228.06 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 42.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.06425 |
| Heavy Atoms | 14 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 83373-60-8 |
|---|---|
| SMILES | C1CC2C(C1)C3CC2CC3OC(=S)S |
| InChIKey | PWLXJBSAUKKGCM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
三环癸烷-9-基黄原酸酯（外消旋） (CAS 83373-60-8), with molecular formula C11H16OS2 and molecular weight 228.06 g/mol. IUPAC: 8-tricyclo[5.2.1.02,6]decanyloxymethanedithioic acid.
Chemical Property Profile of 三环癸烷-9-基黄原酸酯（外消旋）
Property Insights of 三环癸烷-9-基黄原酸酯（外消旋）
The XLogP value of 4.1 indicates that 三环癸烷-9-基黄原酸酯（外消旋） is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.3 Ų, 三环癸烷-9-基黄原酸酯（外消旋） exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 三环癸烷-9-基黄原酸酯（外消旋） has 1 hydrogen bond donor(s) and 3 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 三环癸烷-9-基黄原酸酯（外消旋）?
The CAS number of 三环癸烷-9-基黄原酸酯（外消旋） is 83373-60-8.
What is the molecular formula of 三环癸烷-9-基黄原酸酯（外消旋）?
The molecular formula of 三环癸烷-9-基黄原酸酯（外消旋） is C11H16OS2.
What is the molecular weight of 三环癸烷-9-基黄原酸酯（外消旋）?
The molecular weight of 三环癸烷-9-基黄原酸酯（外消旋） is 228.06 g/mol.
Where can I buy 三环癸烷-9-基黄原酸酯（外消旋）?
You can request a quote for 三环癸烷-9-基黄原酸酯（外消旋） directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三环癸烷-9-基黄原酸酯（外消旋）?
Yes, KEHONG BIO provides custom synthesis services for 三环癸烷-9-基黄原酸酯（外消旋） and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.