![2-Amino-4-[(trifluoromethyl)sulfonyl]benzoic acid structure](/static/products/295/295361-65-8.png)
2-Amino-4-[(trifluoromethyl)sulfonyl]benzoic acid
TL;DR: 2-Amino-4-[(trifluoromethyl)sulfonyl]benzoic acid (CAS 295361-65-8) is a chemical compound with molecular formula C8H6F3NO4S and molecular weight 269.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-(trifluoromethylsulfonyl)benzoic acid
Also Known As: Benzoic acid, 2-amino-4-trifluoromethanesulfonyl-, 2-amino-4-[(trifluoromethyl)sulfonyl]benzoic acid, 2-amino-4-(trifluoromethylsulfonyl)benzoic acid, 2-amino-4-((trifluoromethyl)sulfonyl)benzoic acid, AH-034/11963130
| Molecular Formula | C8H6F3NO4S |
|---|---|
| Molecular Weight | 269.00 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 268.99695 |
| Heavy Atoms | 17 |
| Complexity | 400.0 |
Chemical Identifiers
| CAS Number | 295361-65-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1S(=O)(=O)C(F)(F)F)N)C(=O)O |
| InChIKey | CIYZXGKMPBFLMB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Amino-4-[(trifluoromethyl)sulfonyl]benzoic acid (CAS 295361-65-8), with molecular formula C8H6F3NO4S and molecular weight 269.00 g/mol. IUPAC: 2-amino-4-(trifluoromethylsulfonyl)benzoic acid.
Chemical Property Profile of 2-Amino-4-[(trifluoromethyl)sulfonyl]benzoic acid
Property Insights of 2-Amino-4-[(trifluoromethyl)sulfonyl]benzoic acid
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-4-[(trifluoromethyl)sulfonyl]benzoic acid. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-4-[(trifluoromethyl)sulfonyl]benzoic acid. Following Lipinski's Rule of Five, 2-Amino-4-[(trifluoromethyl)sulfonyl]benzoic acid has 2 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 2-Amino-4-[(trifluoromethyl)sulfonyl]benzoic acid?
The CAS number of 2-Amino-4-[(trifluoromethyl)sulfonyl]benzoic acid is 295361-65-8.
What is the molecular formula of 2-Amino-4-[(trifluoromethyl)sulfonyl]benzoic acid?
The molecular formula of 2-Amino-4-[(trifluoromethyl)sulfonyl]benzoic acid is C8H6F3NO4S.
What is the molecular weight of 2-Amino-4-[(trifluoromethyl)sulfonyl]benzoic acid?
The molecular weight of 2-Amino-4-[(trifluoromethyl)sulfonyl]benzoic acid is 269.00 g/mol.
Where can I buy 2-Amino-4-[(trifluoromethyl)sulfonyl]benzoic acid?
You can request a quote for 2-Amino-4-[(trifluoromethyl)sulfonyl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-4-[(trifluoromethyl)sulfonyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-4-[(trifluoromethyl)sulfonyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.