5-(Fluorosulfonyl)-2-hydroxybenzoic acid
TL;DR: 5-(Fluorosulfonyl)-2-hydroxybenzoic acid (CAS 400-96-4) is a chemical compound with molecular formula C7H5FO5S and molecular weight 219.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-fluorosulfonyl-2-hydroxybenzoic acid
Also Known As: 5-(Fluorosulfonyl)-2-hydroxybenzoic acid, 5-fluorosulfonyl-2-hydroxybenzoic acid, 5-(Fluorosulfonyl)-2-hydroxybenzoicacid, 5-fluorosulfonyl-2-hydroxy-benzoic acid, 5-fluorosulfonyl-2-oxidanyl-benzoic acid
| Molecular Formula | C7H5FO5S |
|---|---|
| Molecular Weight | 219.98 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 219.98418 |
| Heavy Atoms | 14 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 400-96-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1S(=O)(=O)F)C(=O)O)O |
| InChIKey | AHWKZWHBSGGMJR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-(Fluorosulfonyl)-2-hydroxybenzoic acid (CAS 400-96-4), with molecular formula C7H5FO5S and molecular weight 219.98 g/mol. IUPAC: 5-fluorosulfonyl-2-hydroxybenzoic acid.
Chemical Property Profile of 5-(Fluorosulfonyl)-2-hydroxybenzoic acid
Property Insights of 5-(Fluorosulfonyl)-2-hydroxybenzoic acid
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Fluorosulfonyl)-2-hydroxybenzoic acid. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Fluorosulfonyl)-2-hydroxybenzoic acid. Following Lipinski's Rule of Five, 5-(Fluorosulfonyl)-2-hydroxybenzoic acid has 2 hydrogen bond donor(s) and 6 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 5-(Fluorosulfonyl)-2-hydroxybenzoic acid?
The CAS number of 5-(Fluorosulfonyl)-2-hydroxybenzoic acid is 400-96-4.
What is the molecular formula of 5-(Fluorosulfonyl)-2-hydroxybenzoic acid?
The molecular formula of 5-(Fluorosulfonyl)-2-hydroxybenzoic acid is C7H5FO5S.
What is the molecular weight of 5-(Fluorosulfonyl)-2-hydroxybenzoic acid?
The molecular weight of 5-(Fluorosulfonyl)-2-hydroxybenzoic acid is 219.98 g/mol.
Where can I buy 5-(Fluorosulfonyl)-2-hydroxybenzoic acid?
You can request a quote for 5-(Fluorosulfonyl)-2-hydroxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Fluorosulfonyl)-2-hydroxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(Fluorosulfonyl)-2-hydroxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.