Tetraoxo-2H-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonic acid
TL;DR: Tetraoxo-2H-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonic acid (CAS 133476-13-8) is a chemical compound with molecular formula C18H10O10S4 and molecular weight 513.92 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-disulfonic acid
Also Known As: 10,10,14,14-tetraoxo-10, Tetraoxo-2H-dibenzo(d,d')benzo(1,2-b,5,4-b')dithiophene-3,9-disulfonic acid, 10,10,14,14-Tetraoxo-10lambda6,14lambda6-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-disulfonic acid, Tetraoxo-2H-dibenzo(d,d')benzo(1,2-b,5,4-b')dithiophene-3,9-disulfonicacid, 683-509-6
| Molecular Formula | C18H10O10S4 |
|---|---|
| Molecular Weight | 513.92 g/mol |
| LogP | 1.8064 |
| Topological Polar Surface Area | 177.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 513.9157 |
| Heavy Atoms | 32 |
| Complexity | 1700.7245 |
Chemical Identifiers
| CAS Number | 133476-13-8 |
|---|---|
| SMILES | C1=CC2=C(C=C1S(=O)(=O)O)S(=O)(=O)C3=CC4=C(C=C23)C5=C(S4(=O)=O)C=C(C=C5)S(=O)(=O)O |
Product Overview
Tetraoxo-2H-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonic acid (CAS 133476-13-8), with molecular formula C18H10O10S4 and molecular weight 513.92 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-disulfonic acid.
Chemical Property Profile of Tetraoxo-2H-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonic acid
Property Insights of Tetraoxo-2H-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonic acid
The XLogP value of 1.8064 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tetraoxo-2H-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonic acid. The TPSA of 177.02 Ų indicates high polarity, suggesting Tetraoxo-2H-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tetraoxo-2H-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonic acid has 2 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-2H-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonic acid?
The CAS number of Tetraoxo-2H-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonic acid is 133476-13-8.
What is the molecular formula of Tetraoxo-2H-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonic acid?
The molecular formula of Tetraoxo-2H-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonic acid is C18H10O10S4.
What is the molecular weight of Tetraoxo-2H-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonic acid?
The molecular weight of Tetraoxo-2H-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonic acid is 513.92 g/mol.
Where can I buy Tetraoxo-2H-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonic acid?
You can request a quote for Tetraoxo-2H-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetraoxo-2H-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for Tetraoxo-2H-dibenzo(D,D')benzo(1,2-B,5,4-B')dithiophene-3,9-disulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.