![(1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene structure](/static/products/5241/52416-16-7.webp)
(1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene
TL;DR: (1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene (CAS 52416-16-7) is a chemical compound with molecular formula C9H10F3N3 and molecular weight 217.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-N-[[2-(trifluoromethyl)phenyl]diazenyl]methanamine
Also Known As: (1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene, N-methyl-N-[[2-(trifluoromethyl)phenyl]diazenyl]methanamine
| Molecular Formula | C9H10F3N3 |
|---|---|
| Molecular Weight | 217.08 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 28.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.08269 |
| Heavy Atoms | 15 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 52416-16-7 |
|---|---|
| SMILES | CN(C)N=NC1=CC=CC=C1C(F)(F)F |
| InChIKey | MTBRFWITEKOXHH-UHFFFAOYSA-N |
Product Overview
(1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene (CAS 52416-16-7), with molecular formula C9H10F3N3 and molecular weight 217.08 g/mol. IUPAC: N-methyl-N-[[2-(trifluoromethyl)phenyl]diazenyl]methanamine.
Chemical Property Profile of (1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene
Property Insights of (1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene
The XLogP value of 3.7 indicates that (1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.0 Ų, (1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene has 0 hydrogen bond donor(s) and 6 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 (1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene?
The CAS number of (1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene is 52416-16-7.
What is the molecular formula of (1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene?
The molecular formula of (1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene is C9H10F3N3.
What is the molecular weight of (1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene?
The molecular weight of (1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene is 217.08 g/mol.
Where can I buy (1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene?
You can request a quote for (1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene?
Yes, KEHONG BIO provides custom synthesis services for (1E)-3,3-dimethyl-1-[2-(trifluoromethyl)phenyl]triaz-1-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.