3,5-Bis(trifluoromethyl)-2-chloroaniline
TL;DR: 3,5-Bis(trifluoromethyl)-2-chloroaniline (CAS 201593-90-0) is a chemical compound with molecular formula C8H4ClF6N and molecular weight 262.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-3,5-bis(trifluoromethyl)aniline
Also Known As: 2-chloro-3,5-bis(trifluoromethyl)aniline, 2-Fluoro-5-methylpyridine, 3,5-Bis(trifluoromethyl)-2-chloroaniline, Benzenamine, 2-chloro-3,5-bis(trifluoromethyl)-, 0344AB
| Molecular Formula | C8H4ClF6N |
|---|---|
| Molecular Weight | 262.99 g/mol |
| LogP | 3.9598 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 262.99365 |
| Heavy Atoms | 16 |
| Complexity | 408.21518 |
Chemical Identifiers
| CAS Number | 201593-90-0 |
|---|---|
| SMILES | C1=C(C=C(C(=C1C(F)(F)F)Cl)N)C(F)(F)F |
Product Overview
3,5-Bis(trifluoromethyl)-2-chloroaniline (CAS 201593-90-0), with molecular formula C8H4ClF6N and molecular weight 262.99 g/mol. IUPAC: 2-chloro-3,5-bis(trifluoromethyl)aniline.
Chemical Property Profile of 3,5-Bis(trifluoromethyl)-2-chloroaniline
Property Insights of 3,5-Bis(trifluoromethyl)-2-chloroaniline
The XLogP value of 3.9598 indicates that 3,5-Bis(trifluoromethyl)-2-chloroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.02 Ų, 3,5-Bis(trifluoromethyl)-2-chloroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Bis(trifluoromethyl)-2-chloroaniline 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)-2-chloroaniline?
The CAS number of 3,5-Bis(trifluoromethyl)-2-chloroaniline is 201593-90-0.
What is the molecular formula of 3,5-Bis(trifluoromethyl)-2-chloroaniline?
The molecular formula of 3,5-Bis(trifluoromethyl)-2-chloroaniline is C8H4ClF6N.
What is the molecular weight of 3,5-Bis(trifluoromethyl)-2-chloroaniline?
The molecular weight of 3,5-Bis(trifluoromethyl)-2-chloroaniline is 262.99 g/mol.
Where can I buy 3,5-Bis(trifluoromethyl)-2-chloroaniline?
You can request a quote for 3,5-Bis(trifluoromethyl)-2-chloroaniline 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)-2-chloroaniline?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Bis(trifluoromethyl)-2-chloroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.