2-(2-(1,1'-Biphenyl)-4-YL-2-oxoethoxy)benzonitrile
TL;DR: 2-(2-(1,1'-Biphenyl)-4-YL-2-oxoethoxy)benzonitrile (CAS 269075-63-0) is a chemical compound with molecular formula C21H15NO2 and molecular weight 313.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-oxo-2-(4-phenylphenyl)ethoxy]benzonitrile
Also Known As: 2-(2-(1,1'-biphenyl)-4-yl-2-oxoethoxy)benzonitrile, 2-[2-oxo-2-(4-phenylphenyl)ethoxy]benzonitrile, 2-(2-[1,1'-biphenyl]-4-yl-2-oxoethoxy)benzonitrile, 668-420-2, RefChem:452371
| Molecular Formula | C21H15NO2 |
|---|---|
| Molecular Weight | 313.11 g/mol |
| LogP | 4.48698 |
| Topological Polar Surface Area | 50.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 313.1103 |
| Heavy Atoms | 24 |
| Complexity | 877.7172 |
Chemical Identifiers
| CAS Number | 269075-63-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)COC3=CC=CC=C3C#N |
Product Overview
2-(2-(1,1'-Biphenyl)-4-YL-2-oxoethoxy)benzonitrile (CAS 269075-63-0), with molecular formula C21H15NO2 and molecular weight 313.11 g/mol. IUPAC: 2-[2-oxo-2-(4-phenylphenyl)ethoxy]benzonitrile.
Chemical Property Profile of 2-(2-(1,1'-Biphenyl)-4-YL-2-oxoethoxy)benzonitrile
Property Insights of 2-(2-(1,1'-Biphenyl)-4-YL-2-oxoethoxy)benzonitrile
The XLogP value of 4.48698 indicates that 2-(2-(1,1'-Biphenyl)-4-YL-2-oxoethoxy)benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.09 Ų, 2-(2-(1,1'-Biphenyl)-4-YL-2-oxoethoxy)benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-(1,1'-Biphenyl)-4-YL-2-oxoethoxy)benzonitrile has 0 hydrogen bond donor(s) and 3 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-(2-(1,1'-Biphenyl)-4-YL-2-oxoethoxy)benzonitrile?
The CAS number of 2-(2-(1,1'-Biphenyl)-4-YL-2-oxoethoxy)benzonitrile is 269075-63-0.
What is the molecular formula of 2-(2-(1,1'-Biphenyl)-4-YL-2-oxoethoxy)benzonitrile?
The molecular formula of 2-(2-(1,1'-Biphenyl)-4-YL-2-oxoethoxy)benzonitrile is C21H15NO2.
What is the molecular weight of 2-(2-(1,1'-Biphenyl)-4-YL-2-oxoethoxy)benzonitrile?
The molecular weight of 2-(2-(1,1'-Biphenyl)-4-YL-2-oxoethoxy)benzonitrile is 313.11 g/mol.
Where can I buy 2-(2-(1,1'-Biphenyl)-4-YL-2-oxoethoxy)benzonitrile?
You can request a quote for 2-(2-(1,1'-Biphenyl)-4-YL-2-oxoethoxy)benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-(1,1'-Biphenyl)-4-YL-2-oxoethoxy)benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-(1,1'-Biphenyl)-4-YL-2-oxoethoxy)benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.