N-(2-Nitro-3-(trifluoromethyl)phenyl)acetamide
TL;DR: N-(2-Nitro-3-(trifluoromethyl)phenyl)acetamide (CAS 387-19-9) 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.
N-[2-nitro-3-(trifluoromethyl)phenyl]acetamide
Also Known As: N-(2-Nitro-3-(trifluoromethyl)phenyl)acetamide, n-[2-nitro-3-(trifluoromethyl)phenyl]acetamide, Acetamide, N-[2-nitro-3-(trifluoromethyl)phenyl]-, 2'-Nitro-3'-(trifluoromethyl)acetanilide, N-(2-Nitro-3-trifluoromethyl-phenyl)-acetamide
| Molecular Formula | C9H7F3N2O3 |
|---|---|
| Molecular Weight | 248.04 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 248.04088 |
| Heavy Atoms | 17 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 387-19-9 |
|---|---|
| SMILES | CC(=O)NC1=CC=CC(=C1[N+](=O)[O-])C(F)(F)F |
| InChIKey | ITMONGJWFZBCRS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(2-Nitro-3-(trifluoromethyl)phenyl)acetamide (CAS 387-19-9), with molecular formula C9H7F3N2O3 and molecular weight 248.04 g/mol. IUPAC: N-[2-nitro-3-(trifluoromethyl)phenyl]acetamide.
Chemical Property Profile of N-(2-Nitro-3-(trifluoromethyl)phenyl)acetamide
Property Insights of N-(2-Nitro-3-(trifluoromethyl)phenyl)acetamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Nitro-3-(trifluoromethyl)phenyl)acetamide. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-Nitro-3-(trifluoromethyl)phenyl)acetamide. Following Lipinski's Rule of Five, N-(2-Nitro-3-(trifluoromethyl)phenyl)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 N-(2-Nitro-3-(trifluoromethyl)phenyl)acetamide?
The CAS number of N-(2-Nitro-3-(trifluoromethyl)phenyl)acetamide is 387-19-9.
What is the molecular formula of N-(2-Nitro-3-(trifluoromethyl)phenyl)acetamide?
The molecular formula of N-(2-Nitro-3-(trifluoromethyl)phenyl)acetamide is C9H7F3N2O3.
What is the molecular weight of N-(2-Nitro-3-(trifluoromethyl)phenyl)acetamide?
The molecular weight of N-(2-Nitro-3-(trifluoromethyl)phenyl)acetamide is 248.04 g/mol.
Where can I buy N-(2-Nitro-3-(trifluoromethyl)phenyl)acetamide?
You can request a quote for N-(2-Nitro-3-(trifluoromethyl)phenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Nitro-3-(trifluoromethyl)phenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Nitro-3-(trifluoromethyl)phenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.