![2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl- structure](/static/products/5727/57274-52-9.webp)
2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl-
TL;DR: 2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl- (CAS 57274-52-9) is a chemical compound with molecular formula C16H22S12 and molecular weight 597.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-trimethyl-7-[(1,5,7-trimethyl-2,4,6,8,9-pentathiatricyclo[3.3.1.13,7]decan-3-yl)disulfanyl]-2,4,6,8,9-pentathiatricyclo[3.3.1.13,7]decane
Also Known As: 2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl-, 3,3'-Dithiobis(1,5,7-trimethyl-2,4,6,8,9-pentathiaadamantane), 2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis[1,5,7-trimethyl-
| Molecular Formula | C16H22S12 |
|---|---|
| Molecular Weight | 597.84 g/mol |
| LogP | 9.4 |
| Topological Polar Surface Area | 304.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 3 |
| Exact Mass | 597.837 |
| Heavy Atoms | 28 |
| Complexity | 656.0 |
Chemical Identifiers
| CAS Number | 57274-52-9 |
|---|---|
| SMILES | CC12CC3(SC(S1)(SC(S2)(S3)C)C)SSC45CC6(SC(S4)(SC(S6)(S5)C)C)C |
| InChIKey | SDQQARSOVKZJCB-UHFFFAOYSA-N |
Product Overview
2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl- (CAS 57274-52-9), with molecular formula C16H22S12 and molecular weight 597.84 g/mol. IUPAC: 1,3,5-trimethyl-7-[(1,5,7-trimethyl-2,4,6,8,9-pentathiatricyclo[3.3.1.13,7]decan-3-yl)disulfanyl]-2,4,6,8,9-pentathiatricyclo[3.3.1.13,7]decane.
Chemical Property Profile of 2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl-
Property Insights of 2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl-
The XLogP value of 9.4 indicates that 2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 304.0 Ų indicates high polarity, suggesting 2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl- has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl-?
The CAS number of 2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl- is 57274-52-9.
What is the molecular formula of 2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl-?
The molecular formula of 2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl- is C16H22S12.
What is the molecular weight of 2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl-?
The molecular weight of 2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl- is 597.84 g/mol.
Where can I buy 2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl-?
You can request a quote for 2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6,8,9-Pentathiatricyclo[3.3.1.1(3,7)]decane, 3,3'-dithiobis*1,5,7-trimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.