3,5-Bis(trifluoromethyl)-N-ethylaniline
TL;DR: 3,5-Bis(trifluoromethyl)-N-ethylaniline (CAS 2179-79-5) is a chemical compound with molecular formula C10H9F6N and molecular weight 257.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-ethyl-3,5-bis(trifluoromethyl)aniline
Also Known As: 3,5-Bis(trifluoromethyl)-N-ethylaniline, N-ethyl-3,5-bis(trifluoromethyl)aniline, Phenylselenocyanate, 6764AB, 3,5-bis(trifluoromethyl)-n-ethylaniline, tech.
| Molecular Formula | C10H9F6N |
|---|---|
| Molecular Weight | 257.06 g/mol |
| LogP | 4.156 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.0639 |
| Heavy Atoms | 17 |
| Complexity | 360.5131 |
Chemical Identifiers
| CAS Number | 2179-79-5 |
|---|---|
| SMILES | CCNC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F |
Product Overview
3,5-Bis(trifluoromethyl)-N-ethylaniline (CAS 2179-79-5), with molecular formula C10H9F6N and molecular weight 257.06 g/mol. IUPAC: N-ethyl-3,5-bis(trifluoromethyl)aniline.
Chemical Property Profile of 3,5-Bis(trifluoromethyl)-N-ethylaniline
Property Insights of 3,5-Bis(trifluoromethyl)-N-ethylaniline
The XLogP value of 4.156 indicates that 3,5-Bis(trifluoromethyl)-N-ethylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, 3,5-Bis(trifluoromethyl)-N-ethylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Bis(trifluoromethyl)-N-ethylaniline 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 3,5-Bis(trifluoromethyl)-N-ethylaniline?
The CAS number of 3,5-Bis(trifluoromethyl)-N-ethylaniline is 2179-79-5.
What is the molecular formula of 3,5-Bis(trifluoromethyl)-N-ethylaniline?
The molecular formula of 3,5-Bis(trifluoromethyl)-N-ethylaniline is C10H9F6N.
What is the molecular weight of 3,5-Bis(trifluoromethyl)-N-ethylaniline?
The molecular weight of 3,5-Bis(trifluoromethyl)-N-ethylaniline is 257.06 g/mol.
Where can I buy 3,5-Bis(trifluoromethyl)-N-ethylaniline?
You can request a quote for 3,5-Bis(trifluoromethyl)-N-ethylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Bis(trifluoromethyl)-N-ethylaniline?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Bis(trifluoromethyl)-N-ethylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.