![Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate structure](/static/products/2433/24331-83-7.webp)
Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate
TL;DR: Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate (CAS 24331-83-7) is a chemical compound with molecular formula C15H18O6 and molecular weight 294.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate
Also Known As: Vanillalmalonsaeure-diaethylester, diethyl 2-(4-hydroxy-3-methoxybenzylidene)malonate, J1.607.336I, Propanedioic acid,2-[(4-hydroxy-3-methoxyphenyl)methylene]-, 1,3-diethyl ester, Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate
| Molecular Formula | C15H18O6 |
|---|---|
| Molecular Weight | 294.11 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 82.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 294.11035 |
| Heavy Atoms | 21 |
| Complexity | 370.0 |
Chemical Identifiers
| CAS Number | 24331-83-7 |
|---|---|
| SMILES | CCOC(=O)C(=CC1=CC(=C(C=C1)O)OC)C(=O)OCC |
| InChIKey | PLTKCENRRRYKPI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate (CAS 24331-83-7), with molecular formula C15H18O6 and molecular weight 294.11 g/mol. IUPAC: diethyl 2-[(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate.
Chemical Property Profile of Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate
Property Insights of Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate. The TPSA of 82.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate. Following Lipinski's Rule of Five, Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate has 1 hydrogen bond donor(s) and 6 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 Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate?
The CAS number of Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate is 24331-83-7.
What is the molecular formula of Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate?
The molecular formula of Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate is C15H18O6.
What is the molecular weight of Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate?
The molecular weight of Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate is 294.11 g/mol.
Where can I buy Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate?
You can request a quote for Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl [(4-hydroxy-3-methoxyphenyl)methylidene]propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.