3-Ethyl-5-methyl-1,2-oxazole-4-carboxylic acid
TL;DR: 3-Ethyl-5-methyl-1,2-oxazole-4-carboxylic acid (CAS 17147-85-2) is a chemical compound with molecular formula C7H9NO3 and molecular weight 155.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-5-methyl-1,2-oxazole-4-carboxylic acid
Also Known As: 3-Ethyl-5-methylisoxazole-4-carboxylic acid, 3-ethyl-5-methyl-1,2-oxazole-4-carboxylic acid, 3-Ethyl-5-methyl-isoxazole-4-carboxylic acid, 5-Amino-2-chloro-3-picoline?, 8817AA
| Molecular Formula | C7H9NO3 |
|---|---|
| Molecular Weight | 155.06 g/mol |
| LogP | 1.24362 |
| Topological Polar Surface Area | 63.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 155.05824 |
| Heavy Atoms | 11 |
| Complexity | 277.2131 |
Chemical Identifiers
| CAS Number | 17147-85-2 |
|---|---|
| SMILES | CCC1=NOC(=C1C(=O)O)C |
Product Overview
3-Ethyl-5-methyl-1,2-oxazole-4-carboxylic acid (CAS 17147-85-2), with molecular formula C7H9NO3 and molecular weight 155.06 g/mol. IUPAC: 3-ethyl-5-methyl-1,2-oxazole-4-carboxylic acid.
Chemical Property Profile of 3-Ethyl-5-methyl-1,2-oxazole-4-carboxylic acid
Property Insights of 3-Ethyl-5-methyl-1,2-oxazole-4-carboxylic acid
The XLogP value of 1.24362 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Ethyl-5-methyl-1,2-oxazole-4-carboxylic acid. The TPSA of 63.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Ethyl-5-methyl-1,2-oxazole-4-carboxylic acid. Following Lipinski's Rule of Five, 3-Ethyl-5-methyl-1,2-oxazole-4-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-Ethyl-5-methyl-1,2-oxazole-4-carboxylic acid?
The CAS number of 3-Ethyl-5-methyl-1,2-oxazole-4-carboxylic acid is 17147-85-2.
What is the molecular formula of 3-Ethyl-5-methyl-1,2-oxazole-4-carboxylic acid?
The molecular formula of 3-Ethyl-5-methyl-1,2-oxazole-4-carboxylic acid is C7H9NO3.
What is the molecular weight of 3-Ethyl-5-methyl-1,2-oxazole-4-carboxylic acid?
The molecular weight of 3-Ethyl-5-methyl-1,2-oxazole-4-carboxylic acid is 155.06 g/mol.
Where can I buy 3-Ethyl-5-methyl-1,2-oxazole-4-carboxylic acid?
You can request a quote for 3-Ethyl-5-methyl-1,2-oxazole-4-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-Ethyl-5-methyl-1,2-oxazole-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethyl-5-methyl-1,2-oxazole-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.