3-(2,3,4,5,6-Pentafluorophenoxy)aniline
TL;DR: 3-(2,3,4,5,6-Pentafluorophenoxy)aniline (CAS 294852-08-7) is a chemical compound with molecular formula C12H6F5NO and molecular weight 275.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,3,4,5,6-pentafluorophenoxy)aniline
Also Known As: 3-(2,3,4,5,6-pentafluorophenoxy)aniline, 3-pentafluorophenoxyaniline
| Molecular Formula | C12H6F5NO |
|---|---|
| Molecular Weight | 275.04 g/mol |
| LogP | 3.7566 |
| Topological Polar Surface Area | 35.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 275.03696 |
| Heavy Atoms | 19 |
| Complexity | 615.25226 |
Chemical Identifiers
| CAS Number | 294852-08-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OC2=C(C(=C(C(=C2F)F)F)F)F)N |
Product Overview
3-(2,3,4,5,6-Pentafluorophenoxy)aniline (CAS 294852-08-7), with molecular formula C12H6F5NO and molecular weight 275.04 g/mol. IUPAC: 3-(2,3,4,5,6-pentafluorophenoxy)aniline.
Chemical Property Profile of 3-(2,3,4,5,6-Pentafluorophenoxy)aniline
Property Insights of 3-(2,3,4,5,6-Pentafluorophenoxy)aniline
The XLogP value of 3.7566 indicates that 3-(2,3,4,5,6-Pentafluorophenoxy)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.25 Ų, 3-(2,3,4,5,6-Pentafluorophenoxy)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2,3,4,5,6-Pentafluorophenoxy)aniline has 1 hydrogen bond donor(s) and 2 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 3-(2,3,4,5,6-Pentafluorophenoxy)aniline?
The CAS number of 3-(2,3,4,5,6-Pentafluorophenoxy)aniline is 294852-08-7.
What is the molecular formula of 3-(2,3,4,5,6-Pentafluorophenoxy)aniline?
The molecular formula of 3-(2,3,4,5,6-Pentafluorophenoxy)aniline is C12H6F5NO.
What is the molecular weight of 3-(2,3,4,5,6-Pentafluorophenoxy)aniline?
The molecular weight of 3-(2,3,4,5,6-Pentafluorophenoxy)aniline is 275.04 g/mol.
Where can I buy 3-(2,3,4,5,6-Pentafluorophenoxy)aniline?
You can request a quote for 3-(2,3,4,5,6-Pentafluorophenoxy)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,3,4,5,6-Pentafluorophenoxy)aniline?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,3,4,5,6-Pentafluorophenoxy)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.