![2-[3-(2-Cyanophenoxy)propoxy]benzonitrile structure](/static/products/872/87226-86-6.png)
2-[3-(2-Cyanophenoxy)propoxy]benzonitrile
TL;DR: 2-[3-(2-Cyanophenoxy)propoxy]benzonitrile (CAS 87226-86-6) is a chemical compound with molecular formula C17H14N2O2 and molecular weight 278.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(2-cyanophenoxy)propoxy]benzonitrile
Also Known As: 2-[3-(2-cyanophenoxy)propoxy]benzonitrile, J1.712.551F, 2,2 -(1,3-Propanediylbisoxy)bisbenzonitrile, 2,2'-[Propane-1,3-diylbis(oxy)]dibenzonitrile
| Molecular Formula | C17H14N2O2 |
|---|---|
| Molecular Weight | 278.11 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 66.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 278.10553 |
| Heavy Atoms | 21 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 87226-86-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C#N)OCCCOC2=CC=CC=C2C#N |
| InChIKey | OKXRRZBGHCRYLH-UHFFFAOYSA-N |
Product Overview
2-[3-(2-Cyanophenoxy)propoxy]benzonitrile (CAS 87226-86-6), with molecular formula C17H14N2O2 and molecular weight 278.11 g/mol. IUPAC: 2-[3-(2-cyanophenoxy)propoxy]benzonitrile.
Chemical Property Profile of 2-[3-(2-Cyanophenoxy)propoxy]benzonitrile
Property Insights of 2-[3-(2-Cyanophenoxy)propoxy]benzonitrile
The XLogP value of 3.4 indicates that 2-[3-(2-Cyanophenoxy)propoxy]benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[3-(2-Cyanophenoxy)propoxy]benzonitrile. Following Lipinski's Rule of Five, 2-[3-(2-Cyanophenoxy)propoxy]benzonitrile 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 2-[3-(2-Cyanophenoxy)propoxy]benzonitrile?
The CAS number of 2-[3-(2-Cyanophenoxy)propoxy]benzonitrile is 87226-86-6.
What is the molecular formula of 2-[3-(2-Cyanophenoxy)propoxy]benzonitrile?
The molecular formula of 2-[3-(2-Cyanophenoxy)propoxy]benzonitrile is C17H14N2O2.
What is the molecular weight of 2-[3-(2-Cyanophenoxy)propoxy]benzonitrile?
The molecular weight of 2-[3-(2-Cyanophenoxy)propoxy]benzonitrile is 278.11 g/mol.
Where can I buy 2-[3-(2-Cyanophenoxy)propoxy]benzonitrile?
You can request a quote for 2-[3-(2-Cyanophenoxy)propoxy]benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[3-(2-Cyanophenoxy)propoxy]benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(2-Cyanophenoxy)propoxy]benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.