Dihydroxyphenylene thiosulfonate
TL;DR: Dihydroxyphenylene thiosulfonate (CAS 71240-48-7) is a chemical compound with molecular formula C6H6O5S2 and molecular weight 221.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dihydroxy-2-sulfosulfanylbenzene
Also Known As: Dihydroxyphenylene thiosulfonate, 2-(Sulfothio)hydroquinone, 1,4-dihydroxy-2-sulfosulfanylbenzene, (2,5-dihydroxyphenyl)sulfanesulfonic acid, J1.535.727D
| Molecular Formula | C6H6O5S2 |
|---|---|
| Molecular Weight | 221.97 g/mol |
| LogP | 0.9927 |
| Topological Polar Surface Area | 94.83 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.96567 |
| Heavy Atoms | 13 |
| Complexity | 411.03284 |
Chemical Identifiers
| CAS Number | 71240-48-7 |
|---|---|
| SMILES | C1=CC(=C(C=C1O)SS(=O)(=O)O)O |
Product Overview
Dihydroxyphenylene thiosulfonate (CAS 71240-48-7), with molecular formula C6H6O5S2 and molecular weight 221.97 g/mol. IUPAC: 1,4-dihydroxy-2-sulfosulfanylbenzene.
Chemical Property Profile of Dihydroxyphenylene thiosulfonate
Property Insights of Dihydroxyphenylene thiosulfonate
The XLogP value of 0.9927 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dihydroxyphenylene thiosulfonate. The TPSA of 94.83 Ų falls within the moderate polarity range, balancing permeability and solubility for Dihydroxyphenylene thiosulfonate. Following Lipinski's Rule of Five, Dihydroxyphenylene thiosulfonate has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dihydroxyphenylene thiosulfonate?
The CAS number of Dihydroxyphenylene thiosulfonate is 71240-48-7.
What is the molecular formula of Dihydroxyphenylene thiosulfonate?
The molecular formula of Dihydroxyphenylene thiosulfonate is C6H6O5S2.
What is the molecular weight of Dihydroxyphenylene thiosulfonate?
The molecular weight of Dihydroxyphenylene thiosulfonate is 221.97 g/mol.
Where can I buy Dihydroxyphenylene thiosulfonate?
You can request a quote for Dihydroxyphenylene thiosulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydroxyphenylene thiosulfonate?
Yes, KEHONG BIO provides custom synthesis services for Dihydroxyphenylene thiosulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.