3-(3-Ethoxy-4-hydroxy-benzylidene)-pentane-2,4-dione
TL;DR: 3-(3-Ethoxy-4-hydroxy-benzylidene)-pentane-2,4-dione (CAS 92252-47-6) is a chemical compound with molecular formula C14H16O4 and molecular weight 248.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3-ethoxy-4-hydroxyphenyl)methylidene]pentane-2,4-dione
Also Known As: 3-(3-ethoxy-4-hydroxy-benzylidene)-pentane-2,4-dione, 3-[(3-ethoxy-4-hydroxy-phenyl)methylidene]pentane-2,4-dione, 3-[(3-ethoxy-4-hydroxyphenyl)methylidene]pentane-2,4-dione, 659-500-8, RefChem:491963
| Molecular Formula | C14H16O4 |
|---|---|
| Molecular Weight | 248.10 g/mol |
| LogP | 2.3523 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 248.10486 |
| Heavy Atoms | 18 |
| Complexity | 484.5155 |
Chemical Identifiers
| CAS Number | 92252-47-6 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C=C(C(=O)C)C(=O)C)O |
Product Overview
3-(3-Ethoxy-4-hydroxy-benzylidene)-pentane-2,4-dione (CAS 92252-47-6), with molecular formula C14H16O4 and molecular weight 248.10 g/mol. IUPAC: 3-[(3-ethoxy-4-hydroxyphenyl)methylidene]pentane-2,4-dione.
Chemical Property Profile of 3-(3-Ethoxy-4-hydroxy-benzylidene)-pentane-2,4-dione
Property Insights of 3-(3-Ethoxy-4-hydroxy-benzylidene)-pentane-2,4-dione
The XLogP value of 2.3523 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-Ethoxy-4-hydroxy-benzylidene)-pentane-2,4-dione. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-Ethoxy-4-hydroxy-benzylidene)-pentane-2,4-dione. Following Lipinski's Rule of Five, 3-(3-Ethoxy-4-hydroxy-benzylidene)-pentane-2,4-dione 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 3-(3-Ethoxy-4-hydroxy-benzylidene)-pentane-2,4-dione?
The CAS number of 3-(3-Ethoxy-4-hydroxy-benzylidene)-pentane-2,4-dione is 92252-47-6.
What is the molecular formula of 3-(3-Ethoxy-4-hydroxy-benzylidene)-pentane-2,4-dione?
The molecular formula of 3-(3-Ethoxy-4-hydroxy-benzylidene)-pentane-2,4-dione is C14H16O4.
What is the molecular weight of 3-(3-Ethoxy-4-hydroxy-benzylidene)-pentane-2,4-dione?
The molecular weight of 3-(3-Ethoxy-4-hydroxy-benzylidene)-pentane-2,4-dione is 248.10 g/mol.
Where can I buy 3-(3-Ethoxy-4-hydroxy-benzylidene)-pentane-2,4-dione?
You can request a quote for 3-(3-Ethoxy-4-hydroxy-benzylidene)-pentane-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-Ethoxy-4-hydroxy-benzylidene)-pentane-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Ethoxy-4-hydroxy-benzylidene)-pentane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.