3,4,6-Trifluoro-2-nitroaniline
TL;DR: 3,4,6-Trifluoro-2-nitroaniline (CAS 361-39-7) is a chemical compound with molecular formula C6H3F3N2O2 and molecular weight 192.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,6-trifluoro-2-nitroaniline
Also Known As: 3,4,6-trifluoro-2-nitroaniline, 2-Nitro-3,4,6-trifluoroaniline, 6-Nitro-2,4,5-trifluoroaniline, 346-Trifluoro-2-nitroaniline, 3,4,6-trifluoro-2-nitro-aniline
| Molecular Formula | C6H3F3N2O2 |
|---|---|
| Molecular Weight | 192.01 g/mol |
| LogP | 1.5943 |
| Topological Polar Surface Area | 69.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.01466 |
| Heavy Atoms | 13 |
| Complexity | 354.3824 |
Chemical Identifiers
| CAS Number | 361-39-7 |
|---|---|
| SMILES | C1=C(C(=C(C(=C1F)F)[N+](=O)[O-])N)F |
Product Overview
3,4,6-Trifluoro-2-nitroaniline (CAS 361-39-7), with molecular formula C6H3F3N2O2 and molecular weight 192.01 g/mol. IUPAC: 3,4,6-trifluoro-2-nitroaniline.
Chemical Property Profile of 3,4,6-Trifluoro-2-nitroaniline
Property Insights of 3,4,6-Trifluoro-2-nitroaniline
The XLogP value of 1.5943 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4,6-Trifluoro-2-nitroaniline. The TPSA of 69.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4,6-Trifluoro-2-nitroaniline. Following Lipinski's Rule of Five, 3,4,6-Trifluoro-2-nitroaniline 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 3,4,6-Trifluoro-2-nitroaniline?
The CAS number of 3,4,6-Trifluoro-2-nitroaniline is 361-39-7.
What is the molecular formula of 3,4,6-Trifluoro-2-nitroaniline?
The molecular formula of 3,4,6-Trifluoro-2-nitroaniline is C6H3F3N2O2.
What is the molecular weight of 3,4,6-Trifluoro-2-nitroaniline?
The molecular weight of 3,4,6-Trifluoro-2-nitroaniline is 192.01 g/mol.
Where can I buy 3,4,6-Trifluoro-2-nitroaniline?
You can request a quote for 3,4,6-Trifluoro-2-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,6-Trifluoro-2-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for 3,4,6-Trifluoro-2-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.