![1,1,1-Trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol structure](/static/products/866/866017-69-8.png)
1,1,1-Trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol
TL;DR: 1,1,1-Trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol (CAS 866017-69-8) is a chemical compound with molecular formula C11H11F6NO2 and molecular weight 303.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1-trifluoro-4-[4-(trifluoromethoxy)anilino]butan-2-ol
Also Known As: 1,1,1-trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol, 1,1,1-trifluoro-4-{[4-(trifluoromethoxy)phenyl]amino}butan-2-ol, 1,1,1-trifluoro-4-[4-(trifluoromethoxy)anilino]butan-2-ol, 4R-0676
| Molecular Formula | C11H11F6NO2 |
|---|---|
| Molecular Weight | 303.07 g/mol |
| LogP | 3.3104 |
| Topological Polar Surface Area | 41.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 303.0694 |
| Heavy Atoms | 20 |
| Complexity | 414.4069 |
Chemical Identifiers
| CAS Number | 866017-69-8 |
|---|---|
| SMILES | C1=CC(=CC=C1NCCC(C(F)(F)F)O)OC(F)(F)F |
Product Overview
1,1,1-Trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol (CAS 866017-69-8), with molecular formula C11H11F6NO2 and molecular weight 303.07 g/mol. IUPAC: 1,1,1-trifluoro-4-[4-(trifluoromethoxy)anilino]butan-2-ol.
Chemical Property Profile of 1,1,1-Trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol
Property Insights of 1,1,1-Trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol
The XLogP value of 3.3104 indicates that 1,1,1-Trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.49 Ų, 1,1,1-Trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,1-Trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol has 2 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 1,1,1-Trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol?
The CAS number of 1,1,1-Trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol is 866017-69-8.
What is the molecular formula of 1,1,1-Trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol?
The molecular formula of 1,1,1-Trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol is C11H11F6NO2.
What is the molecular weight of 1,1,1-Trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol?
The molecular weight of 1,1,1-Trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol is 303.07 g/mol.
Where can I buy 1,1,1-Trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol?
You can request a quote for 1,1,1-Trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,1-Trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol?
Yes, KEHONG BIO provides custom synthesis services for 1,1,1-Trifluoro-4-[4-(trifluoromethoxy)anilino]-2-butanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.