ethyl {4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy}acetate
TL;DR: ethyl {4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy}acetate (CAS 675857-67-7) is a chemical compound with molecular formula C20H18N2O6 and molecular weight 382.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy]acetate
Also Known As: ethyl {4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy}acetate, (E)-ethyl 2-(4-(2-cyano-2-(4-nitrophenyl)vinyl)-2-methoxyphenoxy)acetate, ethyl 2-[4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy]acetate
| Molecular Formula | C20H18N2O6 |
|---|---|
| Molecular Weight | 382.12 g/mol |
| LogP | 3.60948 |
| Topological Polar Surface Area | 111.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 382.1165 |
| Heavy Atoms | 28 |
| Complexity | 928.7024 |
Chemical Identifiers
| CAS Number | 675857-67-7 |
|---|---|
| SMILES | CCOC(=O)COC1=C(C=C(C=C1)/C=C(/C#N)\C2=CC=C(C=C2)[N+](=O)[O-])OC |
Product Overview
ethyl {4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy}acetate (CAS 675857-67-7), with molecular formula C20H18N2O6 and molecular weight 382.12 g/mol. IUPAC: ethyl 2-[4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy]acetate.
Chemical Property Profile of ethyl {4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy}acetate
Property Insights of ethyl {4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy}acetate
The XLogP value of 3.60948 indicates that ethyl {4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy}acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.69 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl {4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy}acetate. Following Lipinski's Rule of Five, ethyl {4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy}acetate has 0 hydrogen bond donor(s) and 7 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 ethyl {4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy}acetate?
The CAS number of ethyl {4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy}acetate is 675857-67-7.
What is the molecular formula of ethyl {4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy}acetate?
The molecular formula of ethyl {4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy}acetate is C20H18N2O6.
What is the molecular weight of ethyl {4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy}acetate?
The molecular weight of ethyl {4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy}acetate is 382.12 g/mol.
Where can I buy ethyl {4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy}acetate?
You can request a quote for ethyl {4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy}acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl {4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy}acetate?
Yes, KEHONG BIO provides custom synthesis services for ethyl {4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]-2-methoxyphenoxy}acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.