1-(M-trifluoromethylphenyl)-N-nitrosoanthranilic acid
TL;DR: 1-(M-trifluoromethylphenyl)-N-nitrosoanthranilic acid (CAS 23595-00-8) is a chemical compound with molecular formula C14H9F3N2O3 and molecular weight 310.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[N-nitroso-3-(trifluoromethyl)anilino]benzoic acid
Also Known As: Itf 611, N-Nitroso Flufenamic Acid, 1-(m-Trifluoromethylphenyl)-N-nitrosoanthranilic acid, 2-{nitroso[3-(trifluoromethyl)phenyl]amino}benzoic acid, 2-(Nitroso(3-(trifluoromethyl)phenyl)amino)benzoic acid
| Molecular Formula | C14H9F3N2O3 |
|---|---|
| Molecular Weight | 310.06 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 70.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 310.05652 |
| Heavy Atoms | 22 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 23595-00-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)N(C2=CC=CC(=C2)C(F)(F)F)N=O |
| InChIKey | BDCPSOSZLWKCJC-UHFFFAOYSA-N |
Product Overview
1-(M-trifluoromethylphenyl)-N-nitrosoanthranilic acid (CAS 23595-00-8), with molecular formula C14H9F3N2O3 and molecular weight 310.06 g/mol. IUPAC: 2-[N-nitroso-3-(trifluoromethyl)anilino]benzoic acid.
Chemical Property Profile of 1-(M-trifluoromethylphenyl)-N-nitrosoanthranilic acid
Property Insights of 1-(M-trifluoromethylphenyl)-N-nitrosoanthranilic acid
The XLogP value of 3.7 indicates that 1-(M-trifluoromethylphenyl)-N-nitrosoanthranilic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(M-trifluoromethylphenyl)-N-nitrosoanthranilic acid. Following Lipinski's Rule of Five, 1-(M-trifluoromethylphenyl)-N-nitrosoanthranilic acid has 1 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 1-(M-trifluoromethylphenyl)-N-nitrosoanthranilic acid?
The CAS number of 1-(M-trifluoromethylphenyl)-N-nitrosoanthranilic acid is 23595-00-8.
What is the molecular formula of 1-(M-trifluoromethylphenyl)-N-nitrosoanthranilic acid?
The molecular formula of 1-(M-trifluoromethylphenyl)-N-nitrosoanthranilic acid is C14H9F3N2O3.
What is the molecular weight of 1-(M-trifluoromethylphenyl)-N-nitrosoanthranilic acid?
The molecular weight of 1-(M-trifluoromethylphenyl)-N-nitrosoanthranilic acid is 310.06 g/mol.
Where can I buy 1-(M-trifluoromethylphenyl)-N-nitrosoanthranilic acid?
You can request a quote for 1-(M-trifluoromethylphenyl)-N-nitrosoanthranilic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(M-trifluoromethylphenyl)-N-nitrosoanthranilic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(M-trifluoromethylphenyl)-N-nitrosoanthranilic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.