N-(3-Trifluoromethyl-phenyl)-oxalamic acid
TL;DR: N-(3-Trifluoromethyl-phenyl)-oxalamic acid (CAS 6890-83-1) is a chemical compound with molecular formula C9H6F3NO3 and molecular weight 233.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-oxo-2-[3-(trifluoromethyl)anilino]acetic acid
Also Known As: N-(3-Trifluoromethyl-phenyl)-oxalamic acid, N-(3-Trifluoromethylphenyl)oxalamic acid, 2-oxo-2-[3-(trifluoromethyl)anilino]acetic acid, 2-Oxo-2-((3-(trifluoromethyl)phenyl)amino)acetic acid, {[3-(TRIFLUOROMETHYL)PHENYL]CARBAMOYL}FORMIC ACID
| Molecular Formula | C9H6F3NO3 |
|---|---|
| Molecular Weight | 233.03 g/mol |
| LogP | 1.7285 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 233.02998 |
| Heavy Atoms | 16 |
| Complexity | 428.25253 |
Chemical Identifiers
| CAS Number | 6890-83-1 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=O)C(=O)O)C(F)(F)F |
Product Overview
N-(3-Trifluoromethyl-phenyl)-oxalamic acid (CAS 6890-83-1), with molecular formula C9H6F3NO3 and molecular weight 233.03 g/mol. IUPAC: 2-oxo-2-[3-(trifluoromethyl)anilino]acetic acid.
Chemical Property Profile of N-(3-Trifluoromethyl-phenyl)-oxalamic acid
Property Insights of N-(3-Trifluoromethyl-phenyl)-oxalamic acid
The XLogP value of 1.7285 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-Trifluoromethyl-phenyl)-oxalamic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-Trifluoromethyl-phenyl)-oxalamic acid. Following Lipinski's Rule of Five, N-(3-Trifluoromethyl-phenyl)-oxalamic acid has 2 hydrogen bond donor(s) and 2 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 N-(3-Trifluoromethyl-phenyl)-oxalamic acid?
The CAS number of N-(3-Trifluoromethyl-phenyl)-oxalamic acid is 6890-83-1.
What is the molecular formula of N-(3-Trifluoromethyl-phenyl)-oxalamic acid?
The molecular formula of N-(3-Trifluoromethyl-phenyl)-oxalamic acid is C9H6F3NO3.
What is the molecular weight of N-(3-Trifluoromethyl-phenyl)-oxalamic acid?
The molecular weight of N-(3-Trifluoromethyl-phenyl)-oxalamic acid is 233.03 g/mol.
Where can I buy N-(3-Trifluoromethyl-phenyl)-oxalamic acid?
You can request a quote for N-(3-Trifluoromethyl-phenyl)-oxalamic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-Trifluoromethyl-phenyl)-oxalamic acid?
Yes, KEHONG BIO provides custom synthesis services for N-(3-Trifluoromethyl-phenyl)-oxalamic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.