Tetraoxo-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonyl dichloride
TL;DR: Tetraoxo-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonyl dichloride (CAS 133498-91-6) is a chemical compound with molecular formula C18H8Cl2O8S4 and molecular weight 549.85 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10,10,14,14-tetraoxo-10λ6,14λ6-dithiapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4(9),5,7,11,15(20),16,18-nonaene-7,17-disulfonyl chloride
Also Known As: Tetraoxo-dibenzo(d,d')benzo(1,2-b,5,4-b')dithiophene-3,9-disulfonyl dichloride, Tetraoxo-dibenzo(d,d')benzo(1,2-b,5,4-b')dithiophene-3,9-disulfonyldichloride, 683-466-3, RefChem:897384
| Molecular Formula | C18H8Cl2O8S4 |
|---|---|
| Molecular Weight | 549.85 g/mol |
| LogP | 3.168 |
| Topological Polar Surface Area | 136.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 549.8479 |
| Heavy Atoms | 32 |
| Complexity | 1707.9438 |
Chemical Identifiers
| CAS Number | 133498-91-6 |
|---|---|
| SMILES | C1=CC2=C(C=C1S(=O)(=O)Cl)S(=O)(=O)C3=CC4=C(C=C23)C5=C(S4(=O)=O)C=C(C=C5)S(=O)(=O)Cl |
Product Overview
Tetraoxo-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonyl dichloride (CAS 133498-91-6), with molecular formula C18H8Cl2O8S4 and molecular weight 549.85 g/mol. IUPAC: 10,10,14,14-tetraoxo-10λ6,14λ6-dithiapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4(9),5,7,11,15(20),16,18-nonaene-7,17-disulfonyl chloride.
Chemical Property Profile of Tetraoxo-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonyl dichloride
Property Insights of Tetraoxo-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonyl dichloride
The XLogP value of 3.168 indicates that Tetraoxo-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonyl dichloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 136.56 Ų falls within the moderate polarity range, balancing permeability and solubility for Tetraoxo-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonyl dichloride. Following Lipinski's Rule of Five, Tetraoxo-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonyl dichloride has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tetraoxo-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonyl dichloride?
The CAS number of Tetraoxo-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonyl dichloride is 133498-91-6.
What is the molecular formula of Tetraoxo-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonyl dichloride?
The molecular formula of Tetraoxo-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonyl dichloride is C18H8Cl2O8S4.
What is the molecular weight of Tetraoxo-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonyl dichloride?
The molecular weight of Tetraoxo-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonyl dichloride is 549.85 g/mol.
Where can I buy Tetraoxo-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonyl dichloride?
You can request a quote for Tetraoxo-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonyl dichloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetraoxo-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonyl dichloride?
Yes, KEHONG BIO provides custom synthesis services for Tetraoxo-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonyl dichloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.