![2-AMINO-3-({[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}AMINO)BUT-2-ENEDINITRILE structure](/static/products/1048/1048915-39-4.webp)
2-AMINO-3-({[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}AMINO)BUT-2-ENEDINITRILE
TL;DR: 2-AMINO-3-({[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}AMINO)BUT-2-ENEDINITRILE (CAS 1048915-39-4) is a chemical compound with molecular formula C12H7F3N4 and molecular weight 264.0623 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-3-[[3-(trifluoromethyl)phenyl]methylideneamino]but-2-enedinitrile
Also Known As: 2-AMINO-3-({[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}AMINO)BUT-2-ENEDINITRILE, 2-amino-3-[[3-(trifluoromethyl)phenyl]methylideneamino]but-2-enedinitrile, (Z)-2-amino-3-({(E)-[3-(trifluoromethyl)phenyl]methylidene}amino)-2-butenedinitrile, 2-amino-3-[[3-(trifluoromethyl)phenyl]methyleneamino]but-2-enedinitrile, (2Z)-2-amino-3-[(E)-{[3-(trifluoromethyl)phenyl]methylidene}amino]but-2-enedinitrile
Technical Specifications
| Molecular Formula | C12H7F3N4 |
| Molecular Weight | 264.0623 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 86.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 264.0623 Da |
| Heavy Atoms | 19 |
| Complexity | 486.0 |
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)C=NC(=C(C#N)N)C#N |
| InChIKey | LBSUTUIPWBSUPS-UHFFFAOYSA-N |
Chemical Property Profile of 2-AMINO-3-({[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}AMINO)BUT-2-ENEDINITRILE
Property Insights of 2-AMINO-3-({[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}AMINO)BUT-2-ENEDINITRILE
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-AMINO-3-({[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}AMINO)BUT-2-ENEDINITRILE. The TPSA of 86.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-AMINO-3-({[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}AMINO)BUT-2-ENEDINITRILE. Following Lipinski's Rule of Five, 2-AMINO-3-({[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}AMINO)BUT-2-ENEDINITRILE has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-AMINO-3-({[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}AMINO)BUT-2-ENEDINITRILE?
The CAS number of 2-AMINO-3-({[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}AMINO)BUT-2-ENEDINITRILE is 1048915-39-4.
What is the molecular formula of 2-AMINO-3-({[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}AMINO)BUT-2-ENEDINITRILE?
The molecular formula of 2-AMINO-3-({[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}AMINO)BUT-2-ENEDINITRILE is C12H7F3N4.
What is the molecular weight of 2-AMINO-3-({[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}AMINO)BUT-2-ENEDINITRILE?
The molecular weight of 2-AMINO-3-({[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}AMINO)BUT-2-ENEDINITRILE is 264.0623 g/mol.
Where can I buy 2-AMINO-3-({[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}AMINO)BUT-2-ENEDINITRILE?
You can request a quote for 2-AMINO-3-({[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}AMINO)BUT-2-ENEDINITRILE directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-AMINO-3-({[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}AMINO)BUT-2-ENEDINITRILE?
Yes, CoreyChem provides custom synthesis services for 2-AMINO-3-({[3-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}AMINO)BUT-2-ENEDINITRILE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.