2,6-Bis(trifluoromethyl)aniline
TL;DR: 2,6-Bis(trifluoromethyl)aniline (CAS 313-13-3) is a chemical compound with molecular formula C8H5F6N and molecular weight 229.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-bis(trifluoromethyl)aniline
Also Known As: 2,6-Bis(trifluoromethyl)aniline, 2,6-Bis-trifluoromethyl-phenylamine, 2,6-DI(TRIFLUOROMETHYL)ANILINE, 2,6-bis(trifluoromethyl)benzenamine, 2,6-bis(trifluoromethyl)phenylamine
| Molecular Formula | C8H5F6N |
|---|---|
| Molecular Weight | 229.03 g/mol |
| LogP | 3.3064 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 229.03262 |
| Heavy Atoms | 15 |
| Complexity | 332.12512 |
Chemical Identifiers
| CAS Number | 313-13-3 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)C(F)(F)F)N)C(F)(F)F |
Product Overview
2,6-Bis(trifluoromethyl)aniline (CAS 313-13-3), with molecular formula C8H5F6N and molecular weight 229.03 g/mol. IUPAC: 2,6-bis(trifluoromethyl)aniline.
Chemical Property Profile of 2,6-Bis(trifluoromethyl)aniline
Property Insights of 2,6-Bis(trifluoromethyl)aniline
The XLogP value of 3.3064 indicates that 2,6-Bis(trifluoromethyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.02 Ų, 2,6-Bis(trifluoromethyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Bis(trifluoromethyl)aniline has 1 hydrogen bond donor(s) and 1 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 2,6-Bis(trifluoromethyl)aniline?
The CAS number of 2,6-Bis(trifluoromethyl)aniline is 313-13-3.
What is the molecular formula of 2,6-Bis(trifluoromethyl)aniline?
The molecular formula of 2,6-Bis(trifluoromethyl)aniline is C8H5F6N.
What is the molecular weight of 2,6-Bis(trifluoromethyl)aniline?
The molecular weight of 2,6-Bis(trifluoromethyl)aniline is 229.03 g/mol.
Where can I buy 2,6-Bis(trifluoromethyl)aniline?
You can request a quote for 2,6-Bis(trifluoromethyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Bis(trifluoromethyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Bis(trifluoromethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.