![3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile structure](/static/products/1761/176162-29-1.webp)
3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile
TL;DR: 3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile (CAS 176162-29-1) is a chemical compound with molecular formula C12H6F3N3O and molecular weight 265.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(trifluoromethyl)phenoxy]pyrazine-2-carbonitrile
Also Known As: 3-[3-(trifluoromethyl)phenoxy]pyrazine-2-carbonitrile, 3-(3-(Trifluoromethyl)phenoxy)pyrazine-2-carbonitrile, 11K-396S, 2-(3-trifluoromethylphenoxy)-3-cyanopyrazine, 3-[3-(Trifluoromethyl)phenoxy]-pyrazine-2-carbonitrile
| Molecular Formula | C12H6F3N3O |
|---|---|
| Molecular Weight | 265.05 g/mol |
| LogP | 3.15938 |
| Topological Polar Surface Area | 58.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 265.0463 |
| Heavy Atoms | 19 |
| Complexity | 634.6021 |
Chemical Identifiers
| CAS Number | 176162-29-1 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OC2=NC=CN=C2C#N)C(F)(F)F |
Product Overview
3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile (CAS 176162-29-1), with molecular formula C12H6F3N3O and molecular weight 265.05 g/mol. IUPAC: 3-[3-(trifluoromethyl)phenoxy]pyrazine-2-carbonitrile.
Chemical Property Profile of 3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile
Property Insights of 3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile
The XLogP value of 3.15938 indicates that 3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.8 Ų, 3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile has 0 hydrogen bond donor(s) and 4 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 3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile?
The CAS number of 3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile is 176162-29-1.
What is the molecular formula of 3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile?
The molecular formula of 3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile is C12H6F3N3O.
What is the molecular weight of 3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile?
The molecular weight of 3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile is 265.05 g/mol.
Where can I buy 3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile?
You can request a quote for 3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.