2-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylic acid
TL;DR: 2-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylic acid (CAS 853344-58-8) is a chemical compound with molecular formula C15H11NO4 and molecular weight 269.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-[5-(4-methoxyphenyl)furan-2-yl]prop-2-enoic acid
Also Known As: BAS 01056439, 2-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylic acid, 2-Cyano-3-[5-(4-methoxy-phenyl)-furan-2-yl]-acrylic acid, (E)-2-cyano-3-[5-(4-methoxyphenyl)furan-2-yl]prop-2-enoic acid, 2-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylicacid
| Molecular Formula | C15H11NO4 |
|---|---|
| Molecular Weight | 269.07 g/mol |
| LogP | 2.94678 |
| Topological Polar Surface Area | 83.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.06882 |
| Heavy Atoms | 20 |
| Complexity | 689.40875 |
Chemical Identifiers
| CAS Number | 853344-58-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=CC=C(O2)/C=C(\C#N)/C(=O)O |
Product Overview
2-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylic acid (CAS 853344-58-8), with molecular formula C15H11NO4 and molecular weight 269.07 g/mol. IUPAC: (E)-2-cyano-3-[5-(4-methoxyphenyl)furan-2-yl]prop-2-enoic acid.
Chemical Property Profile of 2-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylic acid
Property Insights of 2-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylic acid
The XLogP value of 2.94678 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylic acid. The TPSA of 83.46 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylic acid. Following Lipinski's Rule of Five, 2-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylic 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-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylic acid?
The CAS number of 2-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylic acid is 853344-58-8.
What is the molecular formula of 2-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylic acid?
The molecular formula of 2-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylic acid is C15H11NO4.
What is the molecular weight of 2-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylic acid?
The molecular weight of 2-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylic acid is 269.07 g/mol.
Where can I buy 2-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylic acid?
You can request a quote for 2-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyano-3-(5-(4-methoxyphenyl)furan-2-yl)acrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.