Ethyl 2-hydroxy-4-oxo-4-phenylbutanoate
TL;DR: Ethyl 2-hydroxy-4-oxo-4-phenylbutanoate (CAS 243658-52-8) is a chemical compound with molecular formula C12H14O4 and molecular weight 222.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-hydroxy-4-oxo-4-phenylbutanoate
Also Known As: ethyl 2-hydroxy-4-oxo-4-phenylbutanoate, Benzoyl lactic acid ethyl ester, ethyl 2-hydroxy-4-oxo-4-phenylbutyrate, Ethyl 2-hydroxy-4-oxo-4-phenyl-butanoate, 4-phenyl-2-hydroxy-4-oxobutyric acid ethyl ester
| Molecular Formula | C12H14O4 |
|---|---|
| Molecular Weight | 222.09 g/mol |
| LogP | 1.1834 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 222.0892 |
| Heavy Atoms | 16 |
| Complexity | 358.54132 |
Chemical Identifiers
| CAS Number | 243658-52-8 |
|---|---|
| SMILES | CCOC(=O)C(CC(=O)C1=CC=CC=C1)O |
Product Overview
Ethyl 2-hydroxy-4-oxo-4-phenylbutanoate (CAS 243658-52-8), with molecular formula C12H14O4 and molecular weight 222.09 g/mol. IUPAC: ethyl 2-hydroxy-4-oxo-4-phenylbutanoate.
Chemical Property Profile of Ethyl 2-hydroxy-4-oxo-4-phenylbutanoate
Property Insights of Ethyl 2-hydroxy-4-oxo-4-phenylbutanoate
The XLogP value of 1.1834 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-hydroxy-4-oxo-4-phenylbutanoate. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-hydroxy-4-oxo-4-phenylbutanoate. Following Lipinski's Rule of Five, Ethyl 2-hydroxy-4-oxo-4-phenylbutanoate 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-hydroxy-4-oxo-4-phenylbutanoate?
The CAS number of Ethyl 2-hydroxy-4-oxo-4-phenylbutanoate is 243658-52-8.
What is the molecular formula of Ethyl 2-hydroxy-4-oxo-4-phenylbutanoate?
The molecular formula of Ethyl 2-hydroxy-4-oxo-4-phenylbutanoate is C12H14O4.
What is the molecular weight of Ethyl 2-hydroxy-4-oxo-4-phenylbutanoate?
The molecular weight of Ethyl 2-hydroxy-4-oxo-4-phenylbutanoate is 222.09 g/mol.
Where can I buy Ethyl 2-hydroxy-4-oxo-4-phenylbutanoate?
You can request a quote for Ethyl 2-hydroxy-4-oxo-4-phenylbutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-hydroxy-4-oxo-4-phenylbutanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-hydroxy-4-oxo-4-phenylbutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.