5-Hydroxy-4-methyl-5-(2-oxo-2-phenylethyl)furan-2(5H)-one
TL;DR: 5-Hydroxy-4-methyl-5-(2-oxo-2-phenylethyl)furan-2(5H)-one (CAS 60248-76-2) is a chemical compound with molecular formula C13H12O4 and molecular weight 232.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxy-4-methyl-5-phenacylfuran-2-one
Also Known As: 5-hydroxy-4-methyl-5-phenacylfuran-2-one, 5-hydroxy-4-methyl-5-phenacyl-furan-2-one, 5-Hydroxy-4-methyl-5-(2-oxo-2-phenylethyl)furan-2(5H)-one
| Molecular Formula | C13H12O4 |
|---|---|
| Molecular Weight | 232.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 232.07356 |
| Heavy Atoms | 17 |
| Complexity | 366.0 |
Chemical Identifiers
| CAS Number | 60248-76-2 |
|---|---|
| SMILES | CC1=CC(=O)OC1(CC(=O)C2=CC=CC=C2)O |
| InChIKey | QVJBDIMMBPYULV-UHFFFAOYSA-N |
Product Overview
5-Hydroxy-4-methyl-5-(2-oxo-2-phenylethyl)furan-2(5H)-one (CAS 60248-76-2), with molecular formula C13H12O4 and molecular weight 232.07 g/mol. IUPAC: 5-hydroxy-4-methyl-5-phenacylfuran-2-one.
Chemical Property Profile of 5-Hydroxy-4-methyl-5-(2-oxo-2-phenylethyl)furan-2(5H)-one
Property Insights of 5-Hydroxy-4-methyl-5-(2-oxo-2-phenylethyl)furan-2(5H)-one
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Hydroxy-4-methyl-5-(2-oxo-2-phenylethyl)furan-2(5H)-one. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Hydroxy-4-methyl-5-(2-oxo-2-phenylethyl)furan-2(5H)-one. Following Lipinski's Rule of Five, 5-Hydroxy-4-methyl-5-(2-oxo-2-phenylethyl)furan-2(5H)-one 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 5-Hydroxy-4-methyl-5-(2-oxo-2-phenylethyl)furan-2(5H)-one?
The CAS number of 5-Hydroxy-4-methyl-5-(2-oxo-2-phenylethyl)furan-2(5H)-one is 60248-76-2.
What is the molecular formula of 5-Hydroxy-4-methyl-5-(2-oxo-2-phenylethyl)furan-2(5H)-one?
The molecular formula of 5-Hydroxy-4-methyl-5-(2-oxo-2-phenylethyl)furan-2(5H)-one is C13H12O4.
What is the molecular weight of 5-Hydroxy-4-methyl-5-(2-oxo-2-phenylethyl)furan-2(5H)-one?
The molecular weight of 5-Hydroxy-4-methyl-5-(2-oxo-2-phenylethyl)furan-2(5H)-one is 232.07 g/mol.
Where can I buy 5-Hydroxy-4-methyl-5-(2-oxo-2-phenylethyl)furan-2(5H)-one?
You can request a quote for 5-Hydroxy-4-methyl-5-(2-oxo-2-phenylethyl)furan-2(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Hydroxy-4-methyl-5-(2-oxo-2-phenylethyl)furan-2(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Hydroxy-4-methyl-5-(2-oxo-2-phenylethyl)furan-2(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.