![{2-[(4-Cyanophenyl)amino]-2-oxoethoxy}acetic acid structure](/static/products/694/694436-83-4.png)
{2-[(4-Cyanophenyl)amino]-2-oxoethoxy}acetic acid
TL;DR: {2-[(4-Cyanophenyl)amino]-2-oxoethoxy}acetic acid (CAS 694436-83-4) is a chemical compound with molecular formula C11H10N2O4 and molecular weight 234.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-cyanoanilino)-2-oxoethoxy]acetic acid
Also Known As: Maybridge3_002390, IDI1_013777, [2-(4-cyanoanilino)-2-oxoethoxy]acetic acid, {2-[(4-cyanophenyl)amino]-2-oxoethoxy}acetic acid, 2-[2-(4-cyanoanilino)-2-oxoethoxy]acetic acid
| Molecular Formula | C11H10N2O4 |
|---|---|
| Molecular Weight | 234.06 g/mol |
| LogP | 0.59798 |
| Topological Polar Surface Area | 99.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 234.06406 |
| Heavy Atoms | 17 |
| Complexity | 447.5344 |
Chemical Identifiers
| CAS Number | 694436-83-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C#N)NC(=O)COCC(=O)O |
Product Overview
{2-[(4-Cyanophenyl)amino]-2-oxoethoxy}acetic acid (CAS 694436-83-4), with molecular formula C11H10N2O4 and molecular weight 234.06 g/mol. IUPAC: 2-[2-(4-cyanoanilino)-2-oxoethoxy]acetic acid.
Chemical Property Profile of {2-[(4-Cyanophenyl)amino]-2-oxoethoxy}acetic acid
Property Insights of {2-[(4-Cyanophenyl)amino]-2-oxoethoxy}acetic acid
The XLogP value of 0.59798 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {2-[(4-Cyanophenyl)amino]-2-oxoethoxy}acetic acid. The TPSA of 99.42 Ų falls within the moderate polarity range, balancing permeability and solubility for {2-[(4-Cyanophenyl)amino]-2-oxoethoxy}acetic acid. Following Lipinski's Rule of Five, {2-[(4-Cyanophenyl)amino]-2-oxoethoxy}acetic acid has 2 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-Cyanophenyl)amino]-2-oxoethoxy}acetic acid?
The CAS number of {2-[(4-Cyanophenyl)amino]-2-oxoethoxy}acetic acid is 694436-83-4.
What is the molecular formula of {2-[(4-Cyanophenyl)amino]-2-oxoethoxy}acetic acid?
The molecular formula of {2-[(4-Cyanophenyl)amino]-2-oxoethoxy}acetic acid is C11H10N2O4.
What is the molecular weight of {2-[(4-Cyanophenyl)amino]-2-oxoethoxy}acetic acid?
The molecular weight of {2-[(4-Cyanophenyl)amino]-2-oxoethoxy}acetic acid is 234.06 g/mol.
Where can I buy {2-[(4-Cyanophenyl)amino]-2-oxoethoxy}acetic acid?
You can request a quote for {2-[(4-Cyanophenyl)amino]-2-oxoethoxy}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-Cyanophenyl)amino]-2-oxoethoxy}acetic acid?
Yes, KEHONG BIO provides custom synthesis services for {2-[(4-Cyanophenyl)amino]-2-oxoethoxy}acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.