3-Cyclohexylisoxazole-5-carboxylic acid
TL;DR: 3-Cyclohexylisoxazole-5-carboxylic acid (CAS 876716-46-0) is a chemical compound with molecular formula C10H13NO3 and molecular weight 195.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-cyclohexyl-1,2-oxazole-5-carboxylic acid
Also Known As: 3-cyclohexylisoxazole-5-carboxylic acid, 3-cyclohexyl-1,2-oxazole-5-carboxylic acid, 3-Cyclohexyl-isoxazole-5-carboxylic acid, 1348AF, BAS 10150089
| Molecular Formula | C10H13NO3 |
|---|---|
| Molecular Weight | 195.09 g/mol |
| LogP | 2.4205 |
| Topological Polar Surface Area | 63.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 195.08954 |
| Heavy Atoms | 14 |
| Complexity | 325.86304 |
Chemical Identifiers
| CAS Number | 876716-46-0 |
|---|---|
| SMILES | C1CCC(CC1)C2=NOC(=C2)C(=O)O |
Product Overview
3-Cyclohexylisoxazole-5-carboxylic acid (CAS 876716-46-0), with molecular formula C10H13NO3 and molecular weight 195.09 g/mol. IUPAC: 3-cyclohexyl-1,2-oxazole-5-carboxylic acid.
Chemical Property Profile of 3-Cyclohexylisoxazole-5-carboxylic acid
Property Insights of 3-Cyclohexylisoxazole-5-carboxylic acid
The XLogP value of 2.4205 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Cyclohexylisoxazole-5-carboxylic acid. The TPSA of 63.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Cyclohexylisoxazole-5-carboxylic acid. Following Lipinski's Rule of Five, 3-Cyclohexylisoxazole-5-carboxylic acid has 1 hydrogen bond donor(s) and 3 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 3-Cyclohexylisoxazole-5-carboxylic acid?
The CAS number of 3-Cyclohexylisoxazole-5-carboxylic acid is 876716-46-0.
What is the molecular formula of 3-Cyclohexylisoxazole-5-carboxylic acid?
The molecular formula of 3-Cyclohexylisoxazole-5-carboxylic acid is C10H13NO3.
What is the molecular weight of 3-Cyclohexylisoxazole-5-carboxylic acid?
The molecular weight of 3-Cyclohexylisoxazole-5-carboxylic acid is 195.09 g/mol.
Where can I buy 3-Cyclohexylisoxazole-5-carboxylic acid?
You can request a quote for 3-Cyclohexylisoxazole-5-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Cyclohexylisoxazole-5-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Cyclohexylisoxazole-5-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.