2-(4-Cyano-2-ethoxyphenoxy)acetic acid
TL;DR: 2-(4-Cyano-2-ethoxyphenoxy)acetic acid (CAS 835888-68-1) is a chemical compound with molecular formula C11H11NO4 and molecular weight 221.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-cyano-2-ethoxyphenoxy)acetic acid
Also Known As: 2-(4-cyano-2-ethoxyphenoxy)acetic acid, (4-cyano-2-ethoxyphenoxy)acetic acid, 2-(4-cyano-2-ethoxy-phenoxy)acetic Acid, 2-(4-cyano-2-ethoxyphenoxy)aceticacid, Acetic acid, 2-(4-cyano-2-ethoxyphenoxy)-
| Molecular Formula | C11H11NO4 |
|---|---|
| Molecular Weight | 221.07 g/mol |
| LogP | 1.42038 |
| Topological Polar Surface Area | 79.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 221.0688 |
| Heavy Atoms | 16 |
| Complexity | 422.483 |
Chemical Identifiers
| CAS Number | 835888-68-1 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C#N)OCC(=O)O |
Product Overview
2-(4-Cyano-2-ethoxyphenoxy)acetic acid (CAS 835888-68-1), with molecular formula C11H11NO4 and molecular weight 221.07 g/mol. IUPAC: 2-(4-cyano-2-ethoxyphenoxy)acetic acid.
Chemical Property Profile of 2-(4-Cyano-2-ethoxyphenoxy)acetic acid
Property Insights of 2-(4-Cyano-2-ethoxyphenoxy)acetic acid
The XLogP value of 1.42038 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Cyano-2-ethoxyphenoxy)acetic acid. The TPSA of 79.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Cyano-2-ethoxyphenoxy)acetic acid. Following Lipinski's Rule of Five, 2-(4-Cyano-2-ethoxyphenoxy)acetic acid has 1 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-(4-Cyano-2-ethoxyphenoxy)acetic acid?
The CAS number of 2-(4-Cyano-2-ethoxyphenoxy)acetic acid is 835888-68-1.
What is the molecular formula of 2-(4-Cyano-2-ethoxyphenoxy)acetic acid?
The molecular formula of 2-(4-Cyano-2-ethoxyphenoxy)acetic acid is C11H11NO4.
What is the molecular weight of 2-(4-Cyano-2-ethoxyphenoxy)acetic acid?
The molecular weight of 2-(4-Cyano-2-ethoxyphenoxy)acetic acid is 221.07 g/mol.
Where can I buy 2-(4-Cyano-2-ethoxyphenoxy)acetic acid?
You can request a quote for 2-(4-Cyano-2-ethoxyphenoxy)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Cyano-2-ethoxyphenoxy)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Cyano-2-ethoxyphenoxy)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.