(2,6-Dihydroxy-4-sulfooxyphenyl) hydrogen sulfate
TL;DR: (2,6-Dihydroxy-4-sulfooxyphenyl) hydrogen sulfate (CAS 77860-72-1) is a chemical compound with molecular formula C6H6O10S2 and molecular weight 301.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,6-dihydroxy-4-sulfooxyphenyl) hydrogen sulfate
Also Known As: (2,6-Dihydroxy-4-sulfooxyphenyl) hydrogen sulfate, 1,3-dihydroxy-2,5-disulfooxy-benzene, 2,6-dihydroxybenzene-1,4-diyl bis(hydrogen sulfate), 1,2,3,5-Benzenetetrol,2,5-bis(hydrogen sulfate), 2,6-Dihydroxy-1,4-phenylene bis(hydrogen sulfate)
| Molecular Formula | C6H6O10S2 |
|---|---|
| Molecular Weight | 301.94 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 184.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.94025 |
| Heavy Atoms | 18 |
| Complexity | 457.0 |
Chemical Identifiers
| CAS Number | 77860-72-1 |
|---|---|
| SMILES | C1=C(C=C(C(=C1O)OS(=O)(=O)O)O)OS(=O)(=O)O |
| InChIKey | AVVGQUCGWQSMAQ-UHFFFAOYSA-N |
Product Overview
(2,6-Dihydroxy-4-sulfooxyphenyl) hydrogen sulfate (CAS 77860-72-1), with molecular formula C6H6O10S2 and molecular weight 301.94 g/mol. IUPAC: (2,6-dihydroxy-4-sulfooxyphenyl) hydrogen sulfate.
Chemical Property Profile of (2,6-Dihydroxy-4-sulfooxyphenyl) hydrogen sulfate
Property Insights of (2,6-Dihydroxy-4-sulfooxyphenyl) hydrogen sulfate
The XLogP value of -0.7 indicates that (2,6-Dihydroxy-4-sulfooxyphenyl) hydrogen sulfate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 184.0 Ų indicates high polarity, suggesting (2,6-Dihydroxy-4-sulfooxyphenyl) hydrogen sulfate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (2,6-Dihydroxy-4-sulfooxyphenyl) hydrogen sulfate has 4 hydrogen bond donor(s) and 10 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 (2,6-Dihydroxy-4-sulfooxyphenyl) hydrogen sulfate?
The CAS number of (2,6-Dihydroxy-4-sulfooxyphenyl) hydrogen sulfate is 77860-72-1.
What is the molecular formula of (2,6-Dihydroxy-4-sulfooxyphenyl) hydrogen sulfate?
The molecular formula of (2,6-Dihydroxy-4-sulfooxyphenyl) hydrogen sulfate is C6H6O10S2.
What is the molecular weight of (2,6-Dihydroxy-4-sulfooxyphenyl) hydrogen sulfate?
The molecular weight of (2,6-Dihydroxy-4-sulfooxyphenyl) hydrogen sulfate is 301.94 g/mol.
Where can I buy (2,6-Dihydroxy-4-sulfooxyphenyl) hydrogen sulfate?
You can request a quote for (2,6-Dihydroxy-4-sulfooxyphenyl) hydrogen sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,6-Dihydroxy-4-sulfooxyphenyl) hydrogen sulfate?
Yes, KEHONG BIO provides custom synthesis services for (2,6-Dihydroxy-4-sulfooxyphenyl) hydrogen sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.