1-Hydroxy-5-oxo-2-phenyl-cyclohexanecarboxylic acid
TL;DR: 1-Hydroxy-5-oxo-2-phenyl-cyclohexanecarboxylic acid (CAS 23673-44-1) is a chemical compound with molecular formula C13H14O4 and molecular weight 234.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxy-5-oxo-2-phenylcyclohexane-1-carboxylic acid
Also Known As: 1-Hydroxy-5-oxo-2-phenylcyclohexanecarboxylic acid, NCI60_016403, 1-hydroxy-5-oxo-2-phenyl-cyclohexanecarboxylic acid, 1-hydroxy-5-oxo-2-phenylcyclohexane-1-carboxylic acid
| Molecular Formula | C13H14O4 |
|---|---|
| Molecular Weight | 234.09 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.0892 |
| Heavy Atoms | 17 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 23673-44-1 |
|---|---|
| SMILES | C1CC(=O)CC(C1C2=CC=CC=C2)(C(=O)O)O |
| InChIKey | GJJJBQYNYSREEH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Hydroxy-5-oxo-2-phenyl-cyclohexanecarboxylic acid (CAS 23673-44-1), with molecular formula C13H14O4 and molecular weight 234.09 g/mol. IUPAC: 1-hydroxy-5-oxo-2-phenylcyclohexane-1-carboxylic acid.
Chemical Property Profile of 1-Hydroxy-5-oxo-2-phenyl-cyclohexanecarboxylic acid
Property Insights of 1-Hydroxy-5-oxo-2-phenyl-cyclohexanecarboxylic acid
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Hydroxy-5-oxo-2-phenyl-cyclohexanecarboxylic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Hydroxy-5-oxo-2-phenyl-cyclohexanecarboxylic acid. Following Lipinski's Rule of Five, 1-Hydroxy-5-oxo-2-phenyl-cyclohexanecarboxylic acid has 2 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 1-Hydroxy-5-oxo-2-phenyl-cyclohexanecarboxylic acid?
The CAS number of 1-Hydroxy-5-oxo-2-phenyl-cyclohexanecarboxylic acid is 23673-44-1.
What is the molecular formula of 1-Hydroxy-5-oxo-2-phenyl-cyclohexanecarboxylic acid?
The molecular formula of 1-Hydroxy-5-oxo-2-phenyl-cyclohexanecarboxylic acid is C13H14O4.
What is the molecular weight of 1-Hydroxy-5-oxo-2-phenyl-cyclohexanecarboxylic acid?
The molecular weight of 1-Hydroxy-5-oxo-2-phenyl-cyclohexanecarboxylic acid is 234.09 g/mol.
Where can I buy 1-Hydroxy-5-oxo-2-phenyl-cyclohexanecarboxylic acid?
You can request a quote for 1-Hydroxy-5-oxo-2-phenyl-cyclohexanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hydroxy-5-oxo-2-phenyl-cyclohexanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-Hydroxy-5-oxo-2-phenyl-cyclohexanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.