1,3-Bis(2-cyano-5-(trifluoromethyl)phenyl)triazene
TL;DR: 1,3-Bis(2-cyano-5-(trifluoromethyl)phenyl)triazene (CAS 58458-08-5) is a chemical compound with molecular formula C16H7F6N5 and molecular weight 383.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[2-cyano-5-(trifluoromethyl)phenyl]iminohydrazinyl]-4-(trifluoromethyl)benzonitrile
Also Known As: 1,3-Bctpt, 1,3-bis(2-cyano-5- triazene, 1,3-Bis(2-cyano-5-(trifluoromethyl)phenyl)triazene, 1,3-bis(2cyano-5-trifluoromethylphenyl)triazene, 1,3-bis(2-cyano-5-trifluoromethylphenyl)triazene
| Molecular Formula | C16H7F6N5 |
|---|---|
| Molecular Weight | 383.06 g/mol |
| LogP | 5.57836 |
| Topological Polar Surface Area | 84.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 383.06058 |
| Heavy Atoms | 27 |
| Complexity | 963.2222 |
Chemical Identifiers
| CAS Number | 58458-08-5 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(F)(F)F)NN=NC2=C(C=CC(=C2)C(F)(F)F)C#N)C#N |
Product Overview
1,3-Bis(2-cyano-5-(trifluoromethyl)phenyl)triazene (CAS 58458-08-5), with molecular formula C16H7F6N5 and molecular weight 383.06 g/mol. IUPAC: 2-[2-[2-cyano-5-(trifluoromethyl)phenyl]iminohydrazinyl]-4-(trifluoromethyl)benzonitrile.
Chemical Property Profile of 1,3-Bis(2-cyano-5-(trifluoromethyl)phenyl)triazene
Property Insights of 1,3-Bis(2-cyano-5-(trifluoromethyl)phenyl)triazene
The XLogP value of 5.57836 indicates that 1,3-Bis(2-cyano-5-(trifluoromethyl)phenyl)triazene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Bis(2-cyano-5-(trifluoromethyl)phenyl)triazene. Following Lipinski's Rule of Five, 1,3-Bis(2-cyano-5-(trifluoromethyl)phenyl)triazene has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Bis(2-cyano-5-(trifluoromethyl)phenyl)triazene?
The CAS number of 1,3-Bis(2-cyano-5-(trifluoromethyl)phenyl)triazene is 58458-08-5.
What is the molecular formula of 1,3-Bis(2-cyano-5-(trifluoromethyl)phenyl)triazene?
The molecular formula of 1,3-Bis(2-cyano-5-(trifluoromethyl)phenyl)triazene is C16H7F6N5.
What is the molecular weight of 1,3-Bis(2-cyano-5-(trifluoromethyl)phenyl)triazene?
The molecular weight of 1,3-Bis(2-cyano-5-(trifluoromethyl)phenyl)triazene is 383.06 g/mol.
Where can I buy 1,3-Bis(2-cyano-5-(trifluoromethyl)phenyl)triazene?
You can request a quote for 1,3-Bis(2-cyano-5-(trifluoromethyl)phenyl)triazene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Bis(2-cyano-5-(trifluoromethyl)phenyl)triazene?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Bis(2-cyano-5-(trifluoromethyl)phenyl)triazene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.