![(4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane structure](/static/products/6617/66172-15-4.webp)
(4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane
TL;DR: (4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane (CAS 66172-15-4) is a chemical compound with molecular formula C23H8F24S7 and molecular weight 963.83 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane
Also Known As: (4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane, 2-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-7-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-5-methyl-3,4,6-trithiabicyclo[3.2.0]heptane
| Molecular Formula | C23H8F24S7 |
|---|---|
| Molecular Weight | 963.83 g/mol |
| LogP | 13.9 |
| Topological Polar Surface Area | 177.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 31 |
| Rotatable Bonds | 3 |
| Exact Mass | 963.8288 |
| Heavy Atoms | 54 |
| Complexity | 1590.0 |
Chemical Identifiers
| CAS Number | 66172-15-4 |
|---|---|
| SMILES | CC12C(C(=C(C3(SC(=C(C(F)(F)F)C(F)(F)F)S3)C)C4(SC(=C(C(F)(F)F)C(F)(F)F)S4)C(C(F)(F)F)C(F)(F)F)SS1)C(=C(C(F)(F)F)C(F)(F)F)S2 |
| InChIKey | AKWCOWGHDAEYNG-UHFFFAOYSA-N |
Product Overview
(4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane (CAS 66172-15-4), with molecular formula C23H8F24S7 and molecular weight 963.83 g/mol. IUPAC: 4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane.
Chemical Property Profile of (4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane
Property Insights of (4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane
The XLogP value of 13.9 indicates that (4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 177.0 Ų indicates high polarity, suggesting (4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane has 0 hydrogen bond donor(s) and 31 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane?
The CAS number of (4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane is 66172-15-4.
What is the molecular formula of (4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane?
The molecular formula of (4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane is C23H8F24S7.
What is the molecular weight of (4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane?
The molecular weight of (4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane is 963.83 g/mol.
Where can I buy (4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane?
You can request a quote for (4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane?
Yes, KEHONG BIO provides custom synthesis services for (4E)-4-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-6-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1-methyl-2,3,7-trithiabicyclo[3.2.0]heptane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.