![3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one structure](/static/products/7224/7224-77-3.webp)
3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one
TL;DR: 3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one (CAS 7224-77-3) is a chemical compound with molecular formula C5HCl5OS4 and molecular weight 379.74 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one
Also Known As: 3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one, 1,3,3,4,6-pentachloro-2,5,7,9-tetrathiabicyclo[4.3.0]nonan-8-one, 3a,5,5,6,7a-Pentachlorotetrahydro-2H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one
| Molecular Formula | C5HCl5OS4 |
|---|---|
| Molecular Weight | 379.74 g/mol |
| LogP | 5.5479 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 379.7353 |
| Heavy Atoms | 15 |
| Complexity | 326.54425 |
Chemical Identifiers
| CAS Number | 7224-77-3 |
|---|---|
| SMILES | C1(C(SC2(C(S1)(SC(=O)S2)Cl)Cl)(Cl)Cl)Cl |
Product Overview
3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one (CAS 7224-77-3), with molecular formula C5HCl5OS4 and molecular weight 379.74 g/mol. IUPAC: 3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one.
Chemical Property Profile of 3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one
Property Insights of 3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one
The XLogP value of 5.5479 indicates that 3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one?
The CAS number of 3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one is 7224-77-3.
What is the molecular formula of 3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one?
The molecular formula of 3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one is C5HCl5OS4.
What is the molecular weight of 3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one?
The molecular weight of 3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one is 379.74 g/mol.
Where can I buy 3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one?
You can request a quote for 3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3a,5,5,6,7a-pentachloro-6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.