![5-[(Trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid structure](/static/products/2986/298682-46-9.webp)
5-[(Trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid
TL;DR: 5-[(Trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid (CAS 298682-46-9) is a chemical compound with molecular formula C10H6F3NO5 and molecular weight 277.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2,2,2-trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid
Also Known As: 5-(2,2,2-Trifluoroacetamido)isophthalic acid, 5-[(2,2,2-trifluoroacetyl)amino]benzene-1,3-dicarboxylic Acid, 5-[(trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid, 5-(2,2,2-trifluoroacetylamino)benzene-1,3-dicarboxylic acid
| Molecular Formula | C10H6F3NO5 |
|---|---|
| Molecular Weight | 277.02 g/mol |
| LogP | 1.5838 |
| Topological Polar Surface Area | 103.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.0198 |
| Heavy Atoms | 19 |
| Complexity | 520.33636 |
Chemical Identifiers
| CAS Number | 298682-46-9 |
|---|---|
| SMILES | C1=C(C=C(C=C1C(=O)O)NC(=O)C(F)(F)F)C(=O)O |
Product Overview
5-[(Trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid (CAS 298682-46-9), with molecular formula C10H6F3NO5 and molecular weight 277.02 g/mol. IUPAC: 5-[(2,2,2-trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid.
Chemical Property Profile of 5-[(Trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid
Property Insights of 5-[(Trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid
The XLogP value of 1.5838 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(Trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid. The TPSA of 103.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(Trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid. Following Lipinski's Rule of Five, 5-[(Trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid has 3 hydrogen bond donor(s) and 3 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-[(Trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid?
The CAS number of 5-[(Trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid is 298682-46-9.
What is the molecular formula of 5-[(Trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid?
The molecular formula of 5-[(Trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid is C10H6F3NO5.
What is the molecular weight of 5-[(Trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid?
The molecular weight of 5-[(Trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid is 277.02 g/mol.
Where can I buy 5-[(Trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid?
You can request a quote for 5-[(Trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(Trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-[(Trifluoroacetyl)amino]benzene-1,3-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.