![2-[2-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile structure](/static/products/311/311323-85-0.png)
2-[2-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile
TL;DR: 2-[2-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile (CAS 311323-85-0) is a chemical compound with molecular formula C17H15NO4 and molecular weight 297.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(2,5-dimethoxyphenyl)-2-oxoethoxy]benzonitrile
Also Known As: TimTec1_002587, 2-[2-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile, 2-(2-(2,5-dimethoxyphenyl)-2-oxoethoxy)benzonitrile, 2-[2-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile #, 2-[2-(2,5-dimethoxyphenyl)-2-oxoethoxy]benzenecarbonitrile
| Molecular Formula | C17H15NO4 |
|---|---|
| Molecular Weight | 297.10 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 68.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 297.1001 |
| Heavy Atoms | 22 |
| Complexity | 416.0 |
Chemical Identifiers
| CAS Number | 311323-85-0 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)OC)C(=O)COC2=CC=CC=C2C#N |
| InChIKey | FUIKNNGSYXYUPO-UHFFFAOYSA-N |
Product Overview
2-[2-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile (CAS 311323-85-0), with molecular formula C17H15NO4 and molecular weight 297.10 g/mol. IUPAC: 2-[2-(2,5-dimethoxyphenyl)-2-oxoethoxy]benzonitrile.
Chemical Property Profile of 2-[2-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile
Property Insights of 2-[2-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile
The XLogP value of 3.0 indicates that 2-[2-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile. Following Lipinski's Rule of Five, 2-[2-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile has 0 hydrogen bond donor(s) and 5 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-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile?
The CAS number of 2-[2-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile is 311323-85-0.
What is the molecular formula of 2-[2-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile?
The molecular formula of 2-[2-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile is C17H15NO4.
What is the molecular weight of 2-[2-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile?
The molecular weight of 2-[2-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile is 297.10 g/mol.
Where can I buy 2-[2-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile?
You can request a quote for 2-[2-(2,5-Dimethoxyphenyl)-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-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(2,5-Dimethoxyphenyl)-2-oxoethoxy]benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.