4,5-Dihydroxybenzene-1,3-disulfonate
TL;DR: 4,5-Dihydroxybenzene-1,3-disulfonate (CAS 77310-82-8) is a chemical compound with molecular formula C6H4O8S2-2 and molecular weight 267.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dihydroxybenzene-1,3-disulfonate
Also Known As: Tiferron, TIRON, 3,5-disulfocatechol, Sodium catechol sulfate, 4,5-dihydroxybenzene-1,3-disulfonate
| Molecular Formula | C6H4O8S2-2 |
|---|---|
| Molecular Weight | 267.93 g/mol |
| LogP | -1.094 |
| Topological Polar Surface Area | 154.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.93475 |
| Heavy Atoms | 16 |
| Complexity | 626.73755 |
Chemical Identifiers
| CAS Number | 77310-82-8 |
|---|---|
| SMILES | C1=C(C=C(C(=C1O)O)S(=O)(=O)[O-])S(=O)(=O)[O-] |
Product Overview
4,5-Dihydroxybenzene-1,3-disulfonate (CAS 77310-82-8), with molecular formula C6H4O8S2-2 and molecular weight 267.93 g/mol. IUPAC: 4,5-dihydroxybenzene-1,3-disulfonate.
Chemical Property Profile of 4,5-Dihydroxybenzene-1,3-disulfonate
Property Insights of 4,5-Dihydroxybenzene-1,3-disulfonate
The XLogP value of -1.094 indicates that 4,5-Dihydroxybenzene-1,3-disulfonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 154.86 Ų indicates high polarity, suggesting 4,5-Dihydroxybenzene-1,3-disulfonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4,5-Dihydroxybenzene-1,3-disulfonate has 2 hydrogen bond donor(s) and 8 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 4,5-Dihydroxybenzene-1,3-disulfonate?
The CAS number of 4,5-Dihydroxybenzene-1,3-disulfonate is 77310-82-8.
What is the molecular formula of 4,5-Dihydroxybenzene-1,3-disulfonate?
The molecular formula of 4,5-Dihydroxybenzene-1,3-disulfonate is C6H4O8S2-2.
What is the molecular weight of 4,5-Dihydroxybenzene-1,3-disulfonate?
The molecular weight of 4,5-Dihydroxybenzene-1,3-disulfonate is 267.93 g/mol.
Where can I buy 4,5-Dihydroxybenzene-1,3-disulfonate?
You can request a quote for 4,5-Dihydroxybenzene-1,3-disulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dihydroxybenzene-1,3-disulfonate?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dihydroxybenzene-1,3-disulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.