N-methyl-4-(2,3,5,6-tetrafluoropyridin-4-yl)oxyaniline
TL;DR: N-methyl-4-(2,3,5,6-tetrafluoropyridin-4-yl)oxyaniline (CAS 672887-35-3) is a chemical compound with molecular formula C12H8F4N2O and molecular weight 272.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-4-[(2,3,5,6-tetrafluoro-4-pyridinyl)oxy]aniline
Also Known As: N-methyl-4-(2,3,5,6-tetrafluoropyridin-4-yl)oxyaniline, N-methyl-4-((perfluoropyridin-4-yl)oxy)aniline, N-methyl-4-[(2,3,5,6-tetrafluoropyridin-4-yl)oxy]aniline
| Molecular Formula | C12H8F4N2O |
|---|---|
| Molecular Weight | 272.06 g/mol |
| LogP | 3.472 |
| Topological Polar Surface Area | 34.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 272.05728 |
| Heavy Atoms | 19 |
| Complexity | 575.41864 |
Chemical Identifiers
| CAS Number | 672887-35-3 |
|---|---|
| SMILES | CNC1=CC=C(C=C1)OC2=C(C(=NC(=C2F)F)F)F |
Product Overview
N-methyl-4-(2,3,5,6-tetrafluoropyridin-4-yl)oxyaniline (CAS 672887-35-3), with molecular formula C12H8F4N2O and molecular weight 272.06 g/mol. IUPAC: N-methyl-4-[(2,3,5,6-tetrafluoro-4-pyridinyl)oxy]aniline.
Chemical Property Profile of N-methyl-4-(2,3,5,6-tetrafluoropyridin-4-yl)oxyaniline
Property Insights of N-methyl-4-(2,3,5,6-tetrafluoropyridin-4-yl)oxyaniline
The XLogP value of 3.472 indicates that N-methyl-4-(2,3,5,6-tetrafluoropyridin-4-yl)oxyaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.15 Ų, N-methyl-4-(2,3,5,6-tetrafluoropyridin-4-yl)oxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-methyl-4-(2,3,5,6-tetrafluoropyridin-4-yl)oxyaniline 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 N-methyl-4-(2,3,5,6-tetrafluoropyridin-4-yl)oxyaniline?
The CAS number of N-methyl-4-(2,3,5,6-tetrafluoropyridin-4-yl)oxyaniline is 672887-35-3.
What is the molecular formula of N-methyl-4-(2,3,5,6-tetrafluoropyridin-4-yl)oxyaniline?
The molecular formula of N-methyl-4-(2,3,5,6-tetrafluoropyridin-4-yl)oxyaniline is C12H8F4N2O.
What is the molecular weight of N-methyl-4-(2,3,5,6-tetrafluoropyridin-4-yl)oxyaniline?
The molecular weight of N-methyl-4-(2,3,5,6-tetrafluoropyridin-4-yl)oxyaniline is 272.06 g/mol.
Where can I buy N-methyl-4-(2,3,5,6-tetrafluoropyridin-4-yl)oxyaniline?
You can request a quote for N-methyl-4-(2,3,5,6-tetrafluoropyridin-4-yl)oxyaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-methyl-4-(2,3,5,6-tetrafluoropyridin-4-yl)oxyaniline?
Yes, KEHONG BIO provides custom synthesis services for N-methyl-4-(2,3,5,6-tetrafluoropyridin-4-yl)oxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.