2,2,2-Trifluoro-N-(4-nitrophenyl)acetamide
TL;DR: 2,2,2-Trifluoro-N-(4-nitrophenyl)acetamide (CAS 404-27-3) is a chemical compound with molecular formula C8H5F3N2O3 and molecular weight 234.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trifluoro-N-(4-nitrophenyl)acetamide
Also Known As: 2,2,2-Trifluoro-N-(4-nitrophenyl)acetamide, N-(p-Nitrophenyl)-2,2,2-trifluoroacetamide, p-nitrotrifluoroacetanilide, 4-Nitrotrifluoroacetanilide, 2,2,2-Trifluoro-4'-nitroacetanilide
| Molecular Formula | C8H5F3N2O3 |
|---|---|
| Molecular Weight | 234.03 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 234.02522 |
| Heavy Atoms | 16 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 404-27-3 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)C(F)(F)F)[N+](=O)[O-] |
| InChIKey | BLMWCZBKCOBVAM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2,2-Trifluoro-N-(4-nitrophenyl)acetamide (CAS 404-27-3), with molecular formula C8H5F3N2O3 and molecular weight 234.03 g/mol. IUPAC: 2,2,2-trifluoro-N-(4-nitrophenyl)acetamide.
Chemical Property Profile of 2,2,2-Trifluoro-N-(4-nitrophenyl)acetamide
Property Insights of 2,2,2-Trifluoro-N-(4-nitrophenyl)acetamide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2,2-Trifluoro-N-(4-nitrophenyl)acetamide. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2,2-Trifluoro-N-(4-nitrophenyl)acetamide. Following Lipinski's Rule of Five, 2,2,2-Trifluoro-N-(4-nitrophenyl)acetamide has 1 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 2,2,2-Trifluoro-N-(4-nitrophenyl)acetamide?
The CAS number of 2,2,2-Trifluoro-N-(4-nitrophenyl)acetamide is 404-27-3.
What is the molecular formula of 2,2,2-Trifluoro-N-(4-nitrophenyl)acetamide?
The molecular formula of 2,2,2-Trifluoro-N-(4-nitrophenyl)acetamide is C8H5F3N2O3.
What is the molecular weight of 2,2,2-Trifluoro-N-(4-nitrophenyl)acetamide?
The molecular weight of 2,2,2-Trifluoro-N-(4-nitrophenyl)acetamide is 234.03 g/mol.
Where can I buy 2,2,2-Trifluoro-N-(4-nitrophenyl)acetamide?
You can request a quote for 2,2,2-Trifluoro-N-(4-nitrophenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,2-Trifluoro-N-(4-nitrophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2,2,2-Trifluoro-N-(4-nitrophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.