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N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide
TL;DR: N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide (CAS 260554-68-5) is a chemical compound with molecular formula C15H6F8N2O3 and molecular weight 414.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide
Also Known As: N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide, N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitro-benzamide
| Molecular Formula | C15H6F8N2O3 |
|---|---|
| Molecular Weight | 414.03 g/mol |
| LogP | 5.1629 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 414.02505 |
| Heavy Atoms | 28 |
| Complexity | 921.2729 |
Chemical Identifiers
| CAS Number | 260554-68-5 |
|---|---|
| SMILES | C1=CC(=C(C(=C1[N+](=O)[O-])F)C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)F |
Product Overview
N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide (CAS 260554-68-5), with molecular formula C15H6F8N2O3 and molecular weight 414.03 g/mol. IUPAC: N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide.
Chemical Property Profile of N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide
Property Insights of N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide
The XLogP value of 5.1629 indicates that N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide. Following Lipinski's Rule of Five, N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide?
The CAS number of N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide is 260554-68-5.
What is the molecular formula of N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide?
The molecular formula of N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide is C15H6F8N2O3.
What is the molecular weight of N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide?
The molecular weight of N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide is 414.03 g/mol.
Where can I buy N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide?
You can request a quote for N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3,5-bis(trifluoromethyl)phenyl]-2,6-difluoro-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.