2,2'-Dithiobis(6-fluorobenzoic Acid)
TL;DR: 2,2'-Dithiobis(6-fluorobenzoic Acid) (CAS 147027-64-3) is a chemical compound with molecular formula C14H8F2O4S2 and molecular weight 341.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-carboxy-3-fluorophenyl)disulfanyl]-6-fluorobenzoic acid
Also Known As: 2,2'-Dithiobis(6-fluorobenzoic Acid), 6,6'-Disulfanediylbis(2-fluorobenzoic acid), 2,2/'-Dithiobis(6-fluorobenzoic Acid), Benzoic acid, 2,2'-dithiobis[6-fluoro- (9CI), Bis(2-carboxy-3-fluorophenyl) Disulfide
| Molecular Formula | C14H8F2O4S2 |
|---|---|
| Molecular Weight | 341.98 g/mol |
| LogP | 4.1606 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 341.98322 |
| Heavy Atoms | 22 |
| Complexity | 686.11786 |
Chemical Identifiers
| CAS Number | 147027-64-3 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)SSC2=CC=CC(=C2C(=O)O)F)C(=O)O)F |
Product Overview
2,2'-Dithiobis(6-fluorobenzoic Acid) (CAS 147027-64-3), with molecular formula C14H8F2O4S2 and molecular weight 341.98 g/mol. IUPAC: 2-[(2-carboxy-3-fluorophenyl)disulfanyl]-6-fluorobenzoic acid.
Chemical Property Profile of 2,2'-Dithiobis(6-fluorobenzoic Acid)
Property Insights of 2,2'-Dithiobis(6-fluorobenzoic Acid)
The XLogP value of 4.1606 indicates that 2,2'-Dithiobis(6-fluorobenzoic Acid) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2'-Dithiobis(6-fluorobenzoic Acid). Following Lipinski's Rule of Five, 2,2'-Dithiobis(6-fluorobenzoic Acid) has 2 hydrogen bond donor(s) and 4 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'-Dithiobis(6-fluorobenzoic Acid)?
The CAS number of 2,2'-Dithiobis(6-fluorobenzoic Acid) is 147027-64-3.
What is the molecular formula of 2,2'-Dithiobis(6-fluorobenzoic Acid)?
The molecular formula of 2,2'-Dithiobis(6-fluorobenzoic Acid) is C14H8F2O4S2.
What is the molecular weight of 2,2'-Dithiobis(6-fluorobenzoic Acid)?
The molecular weight of 2,2'-Dithiobis(6-fluorobenzoic Acid) is 341.98 g/mol.
Where can I buy 2,2'-Dithiobis(6-fluorobenzoic Acid)?
You can request a quote for 2,2'-Dithiobis(6-fluorobenzoic 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'-Dithiobis(6-fluorobenzoic Acid)?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-Dithiobis(6-fluorobenzoic Acid) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.