5-(2-Methylpropyl)-1,2-oxazole-3-carboxylic acid
TL;DR: 5-(2-Methylpropyl)-1,2-oxazole-3-carboxylic acid (CAS 150517-80-9) is a chemical compound with molecular formula C8H11NO3 and molecular weight 169.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-methylpropyl)-1,2-oxazole-3-carboxylic acid
Also Known As: 5-isobutylisoxazole-3-carboxylic acid, 5-(2-methylpropyl)-1,2-oxazole-3-carboxylic Acid, 5-Isobutyl-isoxazole-3-carboxylic acid, 3-Isoxazolecarboxylicacid,5- -, 5-isobutylisoxazole-3-carboxylicacid
| Molecular Formula | C8H11NO3 |
|---|---|
| Molecular Weight | 169.07 g/mol |
| LogP | 1.5713 |
| Topological Polar Surface Area | 63.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 169.0739 |
| Heavy Atoms | 12 |
| Complexity | 277.58527 |
Chemical Identifiers
| CAS Number | 150517-80-9 |
|---|---|
| SMILES | CC(C)CC1=CC(=NO1)C(=O)O |
Product Overview
5-(2-Methylpropyl)-1,2-oxazole-3-carboxylic acid (CAS 150517-80-9), with molecular formula C8H11NO3 and molecular weight 169.07 g/mol. IUPAC: 5-(2-methylpropyl)-1,2-oxazole-3-carboxylic acid.
Chemical Property Profile of 5-(2-Methylpropyl)-1,2-oxazole-3-carboxylic acid
Property Insights of 5-(2-Methylpropyl)-1,2-oxazole-3-carboxylic acid
The XLogP value of 1.5713 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-Methylpropyl)-1,2-oxazole-3-carboxylic acid. The TPSA of 63.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-Methylpropyl)-1,2-oxazole-3-carboxylic acid. Following Lipinski's Rule of Five, 5-(2-Methylpropyl)-1,2-oxazole-3-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 5-(2-Methylpropyl)-1,2-oxazole-3-carboxylic acid?
The CAS number of 5-(2-Methylpropyl)-1,2-oxazole-3-carboxylic acid is 150517-80-9.
What is the molecular formula of 5-(2-Methylpropyl)-1,2-oxazole-3-carboxylic acid?
The molecular formula of 5-(2-Methylpropyl)-1,2-oxazole-3-carboxylic acid is C8H11NO3.
What is the molecular weight of 5-(2-Methylpropyl)-1,2-oxazole-3-carboxylic acid?
The molecular weight of 5-(2-Methylpropyl)-1,2-oxazole-3-carboxylic acid is 169.07 g/mol.
Where can I buy 5-(2-Methylpropyl)-1,2-oxazole-3-carboxylic acid?
You can request a quote for 5-(2-Methylpropyl)-1,2-oxazole-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-Methylpropyl)-1,2-oxazole-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-Methylpropyl)-1,2-oxazole-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.