Ethyl (Z)-3-(5-(4-chlorophenyl)furan-2-yl)-2-cyanoacrylate
TL;DR: Ethyl (Z)-3-(5-(4-chlorophenyl)furan-2-yl)-2-cyanoacrylate (CAS 301348-93-6) is a chemical compound with molecular formula C16H12ClNO3 and molecular weight 301.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[5-(4-chlorophenyl)furan-2-yl]-2-cyanoprop-2-enoate
Also Known As: Ethyl (Z)-3-(5-(4-chlorophenyl)furan-2-yl)-2-cyanoacrylate, ethyl 3-[5-(4-chlorophenyl)furan-2-yl]-2-cyanoprop-2-enoate, 2-Propenoic acid, 3-[5-(4-chlorophenyl)-2-furanyl]-2-cyano-,
| Molecular Formula | C16H12ClNO3 |
|---|---|
| Molecular Weight | 301.05 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 63.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 301.05057 |
| Heavy Atoms | 21 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 301348-93-6 |
|---|---|
| SMILES | CCOC(=O)C(=CC1=CC=C(O1)C2=CC=C(C=C2)Cl)C#N |
| InChIKey | YUDSFXQXAVKJOK-UHFFFAOYSA-N |
Product Overview
Ethyl (Z)-3-(5-(4-chlorophenyl)furan-2-yl)-2-cyanoacrylate (CAS 301348-93-6), with molecular formula C16H12ClNO3 and molecular weight 301.05 g/mol. IUPAC: ethyl 3-[5-(4-chlorophenyl)furan-2-yl]-2-cyanoprop-2-enoate.
Chemical Property Profile of Ethyl (Z)-3-(5-(4-chlorophenyl)furan-2-yl)-2-cyanoacrylate
Property Insights of Ethyl (Z)-3-(5-(4-chlorophenyl)furan-2-yl)-2-cyanoacrylate
The XLogP value of 3.9 indicates that Ethyl (Z)-3-(5-(4-chlorophenyl)furan-2-yl)-2-cyanoacrylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl (Z)-3-(5-(4-chlorophenyl)furan-2-yl)-2-cyanoacrylate. Following Lipinski's Rule of Five, Ethyl (Z)-3-(5-(4-chlorophenyl)furan-2-yl)-2-cyanoacrylate has 0 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 Ethyl (Z)-3-(5-(4-chlorophenyl)furan-2-yl)-2-cyanoacrylate?
The CAS number of Ethyl (Z)-3-(5-(4-chlorophenyl)furan-2-yl)-2-cyanoacrylate is 301348-93-6.
What is the molecular formula of Ethyl (Z)-3-(5-(4-chlorophenyl)furan-2-yl)-2-cyanoacrylate?
The molecular formula of Ethyl (Z)-3-(5-(4-chlorophenyl)furan-2-yl)-2-cyanoacrylate is C16H12ClNO3.
What is the molecular weight of Ethyl (Z)-3-(5-(4-chlorophenyl)furan-2-yl)-2-cyanoacrylate?
The molecular weight of Ethyl (Z)-3-(5-(4-chlorophenyl)furan-2-yl)-2-cyanoacrylate is 301.05 g/mol.
Where can I buy Ethyl (Z)-3-(5-(4-chlorophenyl)furan-2-yl)-2-cyanoacrylate?
You can request a quote for Ethyl (Z)-3-(5-(4-chlorophenyl)furan-2-yl)-2-cyanoacrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl (Z)-3-(5-(4-chlorophenyl)furan-2-yl)-2-cyanoacrylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl (Z)-3-(5-(4-chlorophenyl)furan-2-yl)-2-cyanoacrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.