![{2,2,2-Trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile structure](/static/products/339/339348-88-8.png)
{2,2,2-Trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile
TL;DR: {2,2,2-Trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile (CAS 339348-88-8) is a chemical compound with molecular formula C11H5F4N3 and molecular weight 255.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2,2,2-trifluoro-1-(4-fluoroanilino)ethylidene]propanedinitrile
Also Known As: 2-[2,2,2-trifluoro-1-(4-fluoroanilino)ethylidene]propanedinitrile, {2,2,2-trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile, 2-(2,2,2-trifluoro-1-((4-fluorophenyl)amino)ethylidene)malononitrile
| Molecular Formula | C11H5F4N3 |
|---|---|
| Molecular Weight | 255.04 g/mol |
| LogP | 3.10116 |
| Topological Polar Surface Area | 59.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.04196 |
| Heavy Atoms | 18 |
| Complexity | 527.62665 |
Chemical Identifiers
| CAS Number | 339348-88-8 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=C(C#N)C#N)C(F)(F)F)F |
Product Overview
{2,2,2-Trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile (CAS 339348-88-8), with molecular formula C11H5F4N3 and molecular weight 255.04 g/mol. IUPAC: 2-[2,2,2-trifluoro-1-(4-fluoroanilino)ethylidene]propanedinitrile.
Chemical Property Profile of {2,2,2-Trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile
Property Insights of {2,2,2-Trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile
The XLogP value of 3.10116 indicates that {2,2,2-Trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.61 Ų, {2,2,2-Trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, {2,2,2-Trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile has 1 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 {2,2,2-Trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile?
The CAS number of {2,2,2-Trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile is 339348-88-8.
What is the molecular formula of {2,2,2-Trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile?
The molecular formula of {2,2,2-Trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile is C11H5F4N3.
What is the molecular weight of {2,2,2-Trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile?
The molecular weight of {2,2,2-Trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile is 255.04 g/mol.
Where can I buy {2,2,2-Trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile?
You can request a quote for {2,2,2-Trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {2,2,2-Trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for {2,2,2-Trifluoro-1-[(4-fluorophenyl)amino]ethylidene}propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.