5-(4-Chlorophenyl)-5-hydroxy-2-oxooxolane-3-carbonitrile
TL;DR: 5-(4-Chlorophenyl)-5-hydroxy-2-oxooxolane-3-carbonitrile (CAS 124500-03-4) is a chemical compound with molecular formula C11H8ClNO3 and molecular weight 237.01927 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(4-chlorophenyl)-5-hydroxy-2-oxooxolane-3-carbonitrile
Also Known As: 3-Cyano-5-(p-chlorophenyl)-5-hydroxytetrahydrofuran-2-one, 5-(4-chlorophenyl)-5-hydroxy-2-oxooxolane-3-carbonitrile, 3-Furancarbonitrile, tetrahydro-5-(4-chlorophenyl)-5-hydroxy-2-oxo-, Tetrahydro-5-(4-chlorophenyl)-5-hydroxy-2-oxo-3-furancarbonitrile
Technical Specifications
| Molecular Formula | C11H8ClNO3 |
| Molecular Weight | 237.01927 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 70.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 237.01927 Da |
| Heavy Atoms | 16 |
| Complexity | 342.0 |
| SMILES | C1C(C(=O)OC1(C2=CC=C(C=C2)Cl)O)C#N |
| InChIKey | AYZXCAAMWZEXGU-UHFFFAOYSA-N |
Chemical Property Profile of 5-(4-Chlorophenyl)-5-hydroxy-2-oxooxolane-3-carbonitrile
Property Insights of 5-(4-Chlorophenyl)-5-hydroxy-2-oxooxolane-3-carbonitrile
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(4-Chlorophenyl)-5-hydroxy-2-oxooxolane-3-carbonitrile. The TPSA of 70.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-Chlorophenyl)-5-hydroxy-2-oxooxolane-3-carbonitrile. Following Lipinski's Rule of Five, 5-(4-Chlorophenyl)-5-hydroxy-2-oxooxolane-3-carbonitrile 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
What is the CAS number of 5-(4-Chlorophenyl)-5-hydroxy-2-oxooxolane-3-carbonitrile?
The CAS number of 5-(4-Chlorophenyl)-5-hydroxy-2-oxooxolane-3-carbonitrile is 124500-03-4.
What is the molecular formula of 5-(4-Chlorophenyl)-5-hydroxy-2-oxooxolane-3-carbonitrile?
The molecular formula of 5-(4-Chlorophenyl)-5-hydroxy-2-oxooxolane-3-carbonitrile is C11H8ClNO3.
What is the molecular weight of 5-(4-Chlorophenyl)-5-hydroxy-2-oxooxolane-3-carbonitrile?
The molecular weight of 5-(4-Chlorophenyl)-5-hydroxy-2-oxooxolane-3-carbonitrile is 237.01927 g/mol.
Where can I buy 5-(4-Chlorophenyl)-5-hydroxy-2-oxooxolane-3-carbonitrile?
You can request a quote for 5-(4-Chlorophenyl)-5-hydroxy-2-oxooxolane-3-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(4-Chlorophenyl)-5-hydroxy-2-oxooxolane-3-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 5-(4-Chlorophenyl)-5-hydroxy-2-oxooxolane-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.