4-Hydroxy-5-nitrobenzene-1,3-disulfonic acid
TL;DR: 4-Hydroxy-5-nitrobenzene-1,3-disulfonic acid (CAS 88-28-8) is a chemical compound with molecular formula C6H5NO9S2 and molecular weight 298.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-5-nitrobenzene-1,3-disulfonic acid
Also Known As: 4-hydroxy-5-nitrobenzene-1,3-disulfonic acid, 4-Hydroxy-5-nitro-1,3-benzenedisulfonic acid, J2.730.422B
| Molecular Formula | C6H5NO9S2 |
|---|---|
| Molecular Weight | 298.94 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 192.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 298.94058 |
| Heavy Atoms | 18 |
| Complexity | 521.0 |
Chemical Identifiers
| CAS Number | 88-28-8 |
|---|---|
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])O)S(=O)(=O)O)S(=O)(=O)O |
| InChIKey | XDBZXAFUWZROOS-UHFFFAOYSA-N |
Product Overview
4-Hydroxy-5-nitrobenzene-1,3-disulfonic acid (CAS 88-28-8), with molecular formula C6H5NO9S2 and molecular weight 298.94 g/mol. IUPAC: 4-hydroxy-5-nitrobenzene-1,3-disulfonic acid.
Chemical Property Profile of 4-Hydroxy-5-nitrobenzene-1,3-disulfonic acid
Property Insights of 4-Hydroxy-5-nitrobenzene-1,3-disulfonic acid
The XLogP value of -0.6 indicates that 4-Hydroxy-5-nitrobenzene-1,3-disulfonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 192.0 Ų indicates high polarity, suggesting 4-Hydroxy-5-nitrobenzene-1,3-disulfonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-Hydroxy-5-nitrobenzene-1,3-disulfonic acid has 3 hydrogen bond donor(s) and 9 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-Hydroxy-5-nitrobenzene-1,3-disulfonic acid?
The CAS number of 4-Hydroxy-5-nitrobenzene-1,3-disulfonic acid is 88-28-8.
What is the molecular formula of 4-Hydroxy-5-nitrobenzene-1,3-disulfonic acid?
The molecular formula of 4-Hydroxy-5-nitrobenzene-1,3-disulfonic acid is C6H5NO9S2.
What is the molecular weight of 4-Hydroxy-5-nitrobenzene-1,3-disulfonic acid?
The molecular weight of 4-Hydroxy-5-nitrobenzene-1,3-disulfonic acid is 298.94 g/mol.
Where can I buy 4-Hydroxy-5-nitrobenzene-1,3-disulfonic acid?
You can request a quote for 4-Hydroxy-5-nitrobenzene-1,3-disulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxy-5-nitrobenzene-1,3-disulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxy-5-nitrobenzene-1,3-disulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.