Ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate
TL;DR: Ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate (CAS 35679-94-8) is a chemical compound with molecular formula C19H20O4 and molecular weight 312.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate
Also Known As: ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate, Aethyl-5-hydroxy-3-oxo-5,5-diphenylpentanoat, J3.236.762C, 3-Oxo-5-hydroxy-5,5-diphenylvaleric acid ethyl ester, delta-hydroxy-beta-oxo-delta-phenylbenzenepentanoic acid ethyl ester
| Molecular Formula | C19H20O4 |
|---|---|
| Molecular Weight | 312.14 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 312.13617 |
| Heavy Atoms | 23 |
| Complexity | 374.0 |
Chemical Identifiers
| CAS Number | 35679-94-8 |
|---|---|
| SMILES | CCOC(=O)CC(=O)CC(C1=CC=CC=C1)(C2=CC=CC=C2)O |
| InChIKey | VKWFAUIAZALQMZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate (CAS 35679-94-8), with molecular formula C19H20O4 and molecular weight 312.14 g/mol. IUPAC: ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate.
Chemical Property Profile of Ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate
Property Insights of Ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate. Following Lipinski's Rule of Five, Ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate 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 5-hydroxy-3-oxo-5,5-diphenylpentanoate?
The CAS number of Ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate is 35679-94-8.
What is the molecular formula of Ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate?
The molecular formula of Ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate is C19H20O4.
What is the molecular weight of Ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate?
The molecular weight of Ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate is 312.14 g/mol.
Where can I buy Ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate?
You can request a quote for Ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-hydroxy-3-oxo-5,5-diphenylpentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.