2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)acetamide
TL;DR: 2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)acetamide (CAS 61390-94-1) is a chemical compound with molecular formula C9H7F3N2O3 and molecular weight 248.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)acetamide
Also Known As: 2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)acetamide, Acetamide, 2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)-, 2,2,2-trifluoro-N-(4-methyl-3-nitro-phenyl)acetamide
| Molecular Formula | C9H7F3N2O3 |
|---|---|
| Molecular Weight | 248.04 g/mol |
| LogP | 2.40402 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.04088 |
| Heavy Atoms | 17 |
| Complexity | 471.04416 |
Chemical Identifiers
| CAS Number | 61390-94-1 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)C(F)(F)F)[N+](=O)[O-] |
Product Overview
2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)acetamide (CAS 61390-94-1), with molecular formula C9H7F3N2O3 and molecular weight 248.04 g/mol. IUPAC: 2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)acetamide.
Chemical Property Profile of 2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)acetamide
Property Insights of 2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)acetamide
The XLogP value of 2.40402 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)acetamide. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)acetamide. Following Lipinski's Rule of Five, 2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)acetamide has 1 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 2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)acetamide?
The CAS number of 2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)acetamide is 61390-94-1.
What is the molecular formula of 2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)acetamide?
The molecular formula of 2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)acetamide is C9H7F3N2O3.
What is the molecular weight of 2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)acetamide?
The molecular weight of 2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)acetamide is 248.04 g/mol.
Where can I buy 2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)acetamide?
You can request a quote for 2,2,2-trifluoro-N-(4-methyl-3-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-methyl-3-nitrophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2,2,2-trifluoro-N-(4-methyl-3-nitrophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.