N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline
TL;DR: N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline (CAS 849-58-1) is a chemical compound with molecular formula C14H11F3N2O3 and molecular weight 312.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline
Also Known As: N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline, BAS 00510334, (4-methoxyphenyl)[2-nitro-4-(trifluoromethyl)phenyl]amine, (4-Methoxy-phenyl)-(2-nitro-4-trifluoromethyl-phenyl)-amine, N-(4-METHOXYPHENYL)-N-[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]AMINE
| Molecular Formula | C14H11F3N2O3 |
|---|---|
| Molecular Weight | 312.07 g/mol |
| LogP | 4.3658 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.07217 |
| Heavy Atoms | 22 |
| Complexity | 684.72266 |
Chemical Identifiers
| CAS Number | 849-58-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-] |
Product Overview
N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline (CAS 849-58-1), with molecular formula C14H11F3N2O3 and molecular weight 312.07 g/mol. IUPAC: N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline.
Chemical Property Profile of N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline
Property Insights of N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline
The XLogP value of 4.3658 indicates that N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline. Following Lipinski's Rule of Five, N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline has 1 hydrogen bond donor(s) and 4 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-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline?
The CAS number of N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline is 849-58-1.
What is the molecular formula of N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline?
The molecular formula of N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline is C14H11F3N2O3.
What is the molecular weight of N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline?
The molecular weight of N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline is 312.07 g/mol.
Where can I buy N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline?
You can request a quote for N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for N-(4-methoxyphenyl)-2-nitro-4-(trifluoromethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.