![2-({[3-(Trifluoromethyl)phenyl]amino}methylidene)propanedinitrile structure](/static/products/2411/24115-33-1.webp)
2-({[3-(Trifluoromethyl)phenyl]amino}methylidene)propanedinitrile
TL;DR: 2-({[3-(Trifluoromethyl)phenyl]amino}methylidene)propanedinitrile (CAS 24115-33-1) is a chemical compound with molecular formula C11H6F3N3 and molecular weight 237.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-(trifluoromethyl)anilino]methylidene]propanedinitrile
Also Known As: 2-({[3-(trifluoromethyl)phenyl]amino}methylidene)propanedinitrile, 2-{[3-(trifluoromethyl)anilino]methylene}malononitrile, 2-[[3-(trifluoromethyl)anilino]methylidene]propanedinitrile, (((3-(TRIFLUOROMETHYL)PHENYL)AMINO)METHYLENE)METHANE-1,1-DICARBONITRILE, 2-(((3-(Trifluoromethyl)phenyl)amino)methylene)malononitrile
| Molecular Formula | C11H6F3N3 |
|---|---|
| Molecular Weight | 237.05 g/mol |
| LogP | 3.04836 |
| Topological Polar Surface Area | 59.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.05138 |
| Heavy Atoms | 17 |
| Complexity | 501.9888 |
Chemical Identifiers
| CAS Number | 24115-33-1 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC=C(C#N)C#N)C(F)(F)F |
Product Overview
2-({[3-(Trifluoromethyl)phenyl]amino}methylidene)propanedinitrile (CAS 24115-33-1), with molecular formula C11H6F3N3 and molecular weight 237.05 g/mol. IUPAC: 2-[[3-(trifluoromethyl)anilino]methylidene]propanedinitrile.
Chemical Property Profile of 2-({[3-(Trifluoromethyl)phenyl]amino}methylidene)propanedinitrile
Property Insights of 2-({[3-(Trifluoromethyl)phenyl]amino}methylidene)propanedinitrile
The XLogP value of 3.04836 indicates that 2-({[3-(Trifluoromethyl)phenyl]amino}methylidene)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-({[3-(Trifluoromethyl)phenyl]amino}methylidene)propanedinitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-({[3-(Trifluoromethyl)phenyl]amino}methylidene)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-({[3-(Trifluoromethyl)phenyl]amino}methylidene)propanedinitrile?
The CAS number of 2-({[3-(Trifluoromethyl)phenyl]amino}methylidene)propanedinitrile is 24115-33-1.
What is the molecular formula of 2-({[3-(Trifluoromethyl)phenyl]amino}methylidene)propanedinitrile?
The molecular formula of 2-({[3-(Trifluoromethyl)phenyl]amino}methylidene)propanedinitrile is C11H6F3N3.
What is the molecular weight of 2-({[3-(Trifluoromethyl)phenyl]amino}methylidene)propanedinitrile?
The molecular weight of 2-({[3-(Trifluoromethyl)phenyl]amino}methylidene)propanedinitrile is 237.05 g/mol.
Where can I buy 2-({[3-(Trifluoromethyl)phenyl]amino}methylidene)propanedinitrile?
You can request a quote for 2-({[3-(Trifluoromethyl)phenyl]amino}methylidene)propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-({[3-(Trifluoromethyl)phenyl]amino}methylidene)propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-({[3-(Trifluoromethyl)phenyl]amino}methylidene)propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.