Benzenamine, N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)-
TL;DR: Benzenamine, N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)- (CAS 84529-35-1) is a chemical compound with molecular formula C14H8F5N3O4 and molecular weight 377.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)aniline
Also Known As: N-(3,4-Difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)aniline, Benzenamine, N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)-, RefChem:322984
| Molecular Formula | C14H8F5N3O4 |
|---|---|
| Molecular Weight | 377.04 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 94.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 2 |
| Exact Mass | 377.0435 |
| Heavy Atoms | 26 |
| Complexity | 538.0 |
Chemical Identifiers
| CAS Number | 84529-35-1 |
|---|---|
| SMILES | CN(C1=CC(=C(C=C1)F)F)C2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])C(F)(F)F |
| InChIKey | WCBFYSWJMZRNIZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenamine, N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)- (CAS 84529-35-1), with molecular formula C14H8F5N3O4 and molecular weight 377.04 g/mol. IUPAC: N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)aniline.
Chemical Property Profile of Benzenamine, N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)-
Property Insights of Benzenamine, N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)-
The XLogP value of 4.3 indicates that Benzenamine, N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenamine, N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)-. Following Lipinski's Rule of Five, Benzenamine, N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)- has 0 hydrogen bond donor(s) and 10 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 Benzenamine, N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)-?
The CAS number of Benzenamine, N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)- is 84529-35-1.
What is the molecular formula of Benzenamine, N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)-?
The molecular formula of Benzenamine, N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)- is C14H8F5N3O4.
What is the molecular weight of Benzenamine, N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)-?
The molecular weight of Benzenamine, N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)- is 377.04 g/mol.
Where can I buy Benzenamine, N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)-?
You can request a quote for Benzenamine, N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenamine, N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzenamine, N-(3,4-difluorophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.