Benzoic acid, 3,5-disulfo-
TL;DR: Benzoic acid, 3,5-disulfo- (CAS 121-48-2) is a chemical compound with molecular formula C7H6O8S2 and molecular weight 281.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-disulfobenzoic acid
Also Known As: 3,5-disulfobenzoic acid, 3,5-Disulphobenzoic acid, Benzoic acid, 3,5-disulfo-, Ixazomib Impurity 69, 3,5-Disulfobenzoicacid
| Molecular Formula | C7H6O8S2 |
|---|---|
| Molecular Weight | 281.95 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 163.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.9504 |
| Heavy Atoms | 17 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 121-48-2 |
|---|---|
| SMILES | C1=C(C=C(C=C1S(=O)(=O)O)S(=O)(=O)O)C(=O)O |
| InChIKey | LZRAAMHXKXNHEF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzoic acid, 3,5-disulfo- (CAS 121-48-2), with molecular formula C7H6O8S2 and molecular weight 281.95 g/mol. IUPAC: 3,5-disulfobenzoic acid.
Chemical Property Profile of Benzoic acid, 3,5-disulfo-
Property Insights of Benzoic acid, 3,5-disulfo-
The XLogP value of -1.1 indicates that Benzoic acid, 3,5-disulfo- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 163.0 Ų indicates high polarity, suggesting Benzoic acid, 3,5-disulfo- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzoic acid, 3,5-disulfo- has 3 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 Benzoic acid, 3,5-disulfo-?
The CAS number of Benzoic acid, 3,5-disulfo- is 121-48-2.
What is the molecular formula of Benzoic acid, 3,5-disulfo-?
The molecular formula of Benzoic acid, 3,5-disulfo- is C7H6O8S2.
What is the molecular weight of Benzoic acid, 3,5-disulfo-?
The molecular weight of Benzoic acid, 3,5-disulfo- is 281.95 g/mol.
Where can I buy Benzoic acid, 3,5-disulfo-?
You can request a quote for Benzoic acid, 3,5-disulfo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 3,5-disulfo-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 3,5-disulfo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.