![3-Phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one structure](/static/products/3390/339017-24-2.webp)
3-Phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one
TL;DR: 3-Phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one (CAS 339017-24-2) is a chemical compound with molecular formula C17H14F3NO and molecular weight 305.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one
Also Known As: 3-phenyl-4-[4-(trifluoromethyl)anilino]-3-buten-2-one, 3-phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one, 3-phenyl-4-[[4-(trifluoromethyl)phenyl]amino]but-3-en-2-one
| Molecular Formula | C17H14F3NO |
|---|---|
| Molecular Weight | 305.10 g/mol |
| LogP | 4.7474 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.10275 |
| Heavy Atoms | 22 |
| Complexity | 673.3003 |
Chemical Identifiers
| CAS Number | 339017-24-2 |
|---|---|
| SMILES | CC(=O)C(=CNC1=CC=C(C=C1)C(F)(F)F)C2=CC=CC=C2 |
Product Overview
3-Phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one (CAS 339017-24-2), with molecular formula C17H14F3NO and molecular weight 305.10 g/mol. IUPAC: 3-phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one.
Chemical Property Profile of 3-Phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one
Property Insights of 3-Phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one
The XLogP value of 4.7474 indicates that 3-Phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 3-Phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one has 1 hydrogen bond donor(s) and 2 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-Phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one?
The CAS number of 3-Phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one is 339017-24-2.
What is the molecular formula of 3-Phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one?
The molecular formula of 3-Phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one is C17H14F3NO.
What is the molecular weight of 3-Phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one?
The molecular weight of 3-Phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one is 305.10 g/mol.
Where can I buy 3-Phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one?
You can request a quote for 3-Phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenyl-4-[4-(trifluoromethyl)anilino]but-3-en-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.