2,2'-Thiodibenzoic acid
TL;DR: 2,2'-Thiodibenzoic acid (CAS 22219-02-9) is a chemical compound with molecular formula C14H10O4S and molecular weight 274.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-carboxyphenyl)sulfanylbenzoic acid
Also Known As: 2,2'-thiodibenzoic acid, thiodibenzoic acid, 2-(2-carboxyphenyl)sulfanylbenzoic acid, 2,2-Thiodibenzoic acid, bis(2-carboxyphenyl)sulfide
| Molecular Formula | C14H10O4S |
|---|---|
| Molecular Weight | 274.03 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 99.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 274.02997 |
| Heavy Atoms | 19 |
| Complexity | 312.0 |
Chemical Identifiers
| CAS Number | 22219-02-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)SC2=CC=CC=C2C(=O)O |
| InChIKey | BDUPKZTWQYDOGC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2'-Thiodibenzoic acid (CAS 22219-02-9), with molecular formula C14H10O4S and molecular weight 274.03 g/mol. IUPAC: 2-(2-carboxyphenyl)sulfanylbenzoic acid.
Chemical Property Profile of 2,2'-Thiodibenzoic acid
Property Insights of 2,2'-Thiodibenzoic acid
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2'-Thiodibenzoic acid. The TPSA of 99.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2'-Thiodibenzoic acid. Following Lipinski's Rule of Five, 2,2'-Thiodibenzoic acid has 2 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 2,2'-Thiodibenzoic acid?
The CAS number of 2,2'-Thiodibenzoic acid is 22219-02-9.
What is the molecular formula of 2,2'-Thiodibenzoic acid?
The molecular formula of 2,2'-Thiodibenzoic acid is C14H10O4S.
What is the molecular weight of 2,2'-Thiodibenzoic acid?
The molecular weight of 2,2'-Thiodibenzoic acid is 274.03 g/mol.
Where can I buy 2,2'-Thiodibenzoic acid?
You can request a quote for 2,2'-Thiodibenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-Thiodibenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-Thiodibenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.