![SS-Tricyclo[3.3.1.13,7]dec-1-yl ethane(dithioperoxoate) structure](/static/products/983/98395-69-8.png)
SS-Tricyclo[3.3.1.13,7]dec-1-yl ethane(dithioperoxoate)
TL;DR: SS-Tricyclo[3.3.1.13,7]dec-1-yl ethane(dithioperoxoate) (CAS 98395-69-8) is a chemical compound with molecular formula C12H18OS2 and molecular weight 242.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-(1-adamantylsulfanyl) ethanethioate
Also Known As: Acetyl 1-adamantyl disulfide, 1-(Acetyldithio)adamantane, Acetyl 1-adamantyl persulfide, S-(1-adamantylsulfanyl) ethanethioate, Adamantan-1-yl ethane(dithioperoxo)oate
| Molecular Formula | C12H18OS2 |
|---|---|
| Molecular Weight | 242.08 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 67.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.07991 |
| Heavy Atoms | 15 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 98395-69-8 |
|---|---|
| SMILES | CC(=O)SSC12CC3CC(C1)CC(C3)C2 |
| InChIKey | AKEZBSIFYLHHSL-UHFFFAOYSA-N |
Product Overview
SS-Tricyclo[3.3.1.13,7]dec-1-yl ethane(dithioperoxoate) (CAS 98395-69-8), with molecular formula C12H18OS2 and molecular weight 242.08 g/mol. IUPAC: S-(1-adamantylsulfanyl) ethanethioate.
Chemical Property Profile of SS-Tricyclo[3.3.1.13,7]dec-1-yl ethane(dithioperoxoate)
Property Insights of SS-Tricyclo[3.3.1.13,7]dec-1-yl ethane(dithioperoxoate)
The XLogP value of 3.4 indicates that SS-Tricyclo[3.3.1.13,7]dec-1-yl ethane(dithioperoxoate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.7 Ų falls within the moderate polarity range, balancing permeability and solubility for SS-Tricyclo[3.3.1.13,7]dec-1-yl ethane(dithioperoxoate). Following Lipinski's Rule of Five, SS-Tricyclo[3.3.1.13,7]dec-1-yl ethane(dithioperoxoate) has 0 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 SS-Tricyclo[3.3.1.13,7]dec-1-yl ethane(dithioperoxoate)?
The CAS number of SS-Tricyclo[3.3.1.13,7]dec-1-yl ethane(dithioperoxoate) is 98395-69-8.
What is the molecular formula of SS-Tricyclo[3.3.1.13,7]dec-1-yl ethane(dithioperoxoate)?
The molecular formula of SS-Tricyclo[3.3.1.13,7]dec-1-yl ethane(dithioperoxoate) is C12H18OS2.
What is the molecular weight of SS-Tricyclo[3.3.1.13,7]dec-1-yl ethane(dithioperoxoate)?
The molecular weight of SS-Tricyclo[3.3.1.13,7]dec-1-yl ethane(dithioperoxoate) is 242.08 g/mol.
Where can I buy SS-Tricyclo[3.3.1.13,7]dec-1-yl ethane(dithioperoxoate)?
You can request a quote for SS-Tricyclo[3.3.1.13,7]dec-1-yl ethane(dithioperoxoate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SS-Tricyclo[3.3.1.13,7]dec-1-yl ethane(dithioperoxoate)?
Yes, KEHONG BIO provides custom synthesis services for SS-Tricyclo[3.3.1.13,7]dec-1-yl ethane(dithioperoxoate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.