4,4,4-Trifluoro-3-phenoxy-2-phenylbut-2-enenitrile
TL;DR: 4,4,4-Trifluoro-3-phenoxy-2-phenylbut-2-enenitrile (CAS 256508-74-4) is a chemical compound with molecular formula C16H10F3NO and molecular weight 289.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4,4-trifluoro-3-phenoxy-2-phenylbut-2-enenitrile
Also Known As: Maybridge3_006666, 4,4,4-trifluoro-3-phenoxy-2-phenylbut-2-enenitrile, alpha-(2,2,2-Trifluoro-1-phenoxyethylidene)benzeneacetonitrile, I+/--(2,2,2-Trifluoro-1-phenoxyethylidene)benzeneacetonitrile
| Molecular Formula | C16H10F3NO |
|---|---|
| Molecular Weight | 289.07 g/mol |
| LogP | 4.56258 |
| Topological Polar Surface Area | 33.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.07144 |
| Heavy Atoms | 21 |
| Complexity | 670.16345 |
Chemical Identifiers
| CAS Number | 256508-74-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=C(C(F)(F)F)OC2=CC=CC=C2)C#N |
Product Overview
4,4,4-Trifluoro-3-phenoxy-2-phenylbut-2-enenitrile (CAS 256508-74-4), with molecular formula C16H10F3NO and molecular weight 289.07 g/mol. IUPAC: 4,4,4-trifluoro-3-phenoxy-2-phenylbut-2-enenitrile.
Chemical Property Profile of 4,4,4-Trifluoro-3-phenoxy-2-phenylbut-2-enenitrile
Property Insights of 4,4,4-Trifluoro-3-phenoxy-2-phenylbut-2-enenitrile
The XLogP value of 4.56258 indicates that 4,4,4-Trifluoro-3-phenoxy-2-phenylbut-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.02 Ų, 4,4,4-Trifluoro-3-phenoxy-2-phenylbut-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4,4-Trifluoro-3-phenoxy-2-phenylbut-2-enenitrile has 0 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 4,4,4-Trifluoro-3-phenoxy-2-phenylbut-2-enenitrile?
The CAS number of 4,4,4-Trifluoro-3-phenoxy-2-phenylbut-2-enenitrile is 256508-74-4.
What is the molecular formula of 4,4,4-Trifluoro-3-phenoxy-2-phenylbut-2-enenitrile?
The molecular formula of 4,4,4-Trifluoro-3-phenoxy-2-phenylbut-2-enenitrile is C16H10F3NO.
What is the molecular weight of 4,4,4-Trifluoro-3-phenoxy-2-phenylbut-2-enenitrile?
The molecular weight of 4,4,4-Trifluoro-3-phenoxy-2-phenylbut-2-enenitrile is 289.07 g/mol.
Where can I buy 4,4,4-Trifluoro-3-phenoxy-2-phenylbut-2-enenitrile?
You can request a quote for 4,4,4-Trifluoro-3-phenoxy-2-phenylbut-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4,4-Trifluoro-3-phenoxy-2-phenylbut-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 4,4,4-Trifluoro-3-phenoxy-2-phenylbut-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.