![Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate structure](/static/products/5871/58714-57-1.webp)
Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate
TL;DR: Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate (CAS 58714-57-1) is a chemical compound with molecular formula C13H14O4 and molecular weight 234.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(4-hydroxyphenyl)methylidene]-3-oxobutanoate
Also Known As: ethyl 2-(4-hydroxybenzylidene)-3-oxobutanoate, Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate, ethyl 2-[(4-hydroxyphenyl)methylidene]-3-oxobutanoate, 2-acetyl-3-(4-hydroxy-phenyl)-acrylic acid ethyl ester, Ethyl 2-((4-hydroxyphenyl)methylene)-3-oxobutanoate
| Molecular Formula | C13H14O4 |
|---|---|
| Molecular Weight | 234.09 g/mol |
| LogP | 1.9277 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 234.0892 |
| Heavy Atoms | 17 |
| Complexity | 442.9922 |
Chemical Identifiers
| CAS Number | 58714-57-1 |
|---|---|
| SMILES | CCOC(=O)C(=CC1=CC=C(C=C1)O)C(=O)C |
Product Overview
Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate (CAS 58714-57-1), with molecular formula C13H14O4 and molecular weight 234.09 g/mol. IUPAC: ethyl 2-[(4-hydroxyphenyl)methylidene]-3-oxobutanoate.
Chemical Property Profile of Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate
Property Insights of Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate
The XLogP value of 1.9277 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate. Following Lipinski's Rule of Five, Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate 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 Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate?
The CAS number of Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate is 58714-57-1.
What is the molecular formula of Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate?
The molecular formula of Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate is C13H14O4.
What is the molecular weight of Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate?
The molecular weight of Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate is 234.09 g/mol.
Where can I buy Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate?
You can request a quote for Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[(4-hydroxyphenyl)methylene]-3-oxobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.