![5-[(E)-2-phenylethenyl]-1,2-oxazole-3-carboxylic acid structure](/static/products/852/852247-25-7.png)
5-[(E)-2-phenylethenyl]-1,2-oxazole-3-carboxylic acid
TL;DR: 5-[(E)-2-phenylethenyl]-1,2-oxazole-3-carboxylic acid (CAS 852247-25-7) is a chemical compound with molecular formula C12H9NO3 and molecular weight 215.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(E)-2-phenylethenyl]-1,2-oxazole-3-carboxylic acid
Also Known As: 5-Styryl-isoxazole-3-carboxylic acid
| Molecular Formula | C12H9NO3 |
|---|---|
| Molecular Weight | 215.06 g/mol |
| LogP | 2.5432 |
| Topological Polar Surface Area | 63.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 215.05824 |
| Heavy Atoms | 16 |
| Complexity | 514.06995 |
Chemical Identifiers
| CAS Number | 852247-25-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C2=CC(=NO2)C(=O)O |
Product Overview
5-[(E)-2-phenylethenyl]-1,2-oxazole-3-carboxylic acid (CAS 852247-25-7), with molecular formula C12H9NO3 and molecular weight 215.06 g/mol. IUPAC: 5-[(E)-2-phenylethenyl]-1,2-oxazole-3-carboxylic acid.
Chemical Property Profile of 5-[(E)-2-phenylethenyl]-1,2-oxazole-3-carboxylic acid
Property Insights of 5-[(E)-2-phenylethenyl]-1,2-oxazole-3-carboxylic acid
The XLogP value of 2.5432 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(E)-2-phenylethenyl]-1,2-oxazole-3-carboxylic acid. The TPSA of 63.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(E)-2-phenylethenyl]-1,2-oxazole-3-carboxylic acid. Following Lipinski's Rule of Five, 5-[(E)-2-phenylethenyl]-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-[(E)-2-phenylethenyl]-1,2-oxazole-3-carboxylic acid?
The CAS number of 5-[(E)-2-phenylethenyl]-1,2-oxazole-3-carboxylic acid is 852247-25-7.
What is the molecular formula of 5-[(E)-2-phenylethenyl]-1,2-oxazole-3-carboxylic acid?
The molecular formula of 5-[(E)-2-phenylethenyl]-1,2-oxazole-3-carboxylic acid is C12H9NO3.
What is the molecular weight of 5-[(E)-2-phenylethenyl]-1,2-oxazole-3-carboxylic acid?
The molecular weight of 5-[(E)-2-phenylethenyl]-1,2-oxazole-3-carboxylic acid is 215.06 g/mol.
Where can I buy 5-[(E)-2-phenylethenyl]-1,2-oxazole-3-carboxylic acid?
You can request a quote for 5-[(E)-2-phenylethenyl]-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-[(E)-2-phenylethenyl]-1,2-oxazole-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-[(E)-2-phenylethenyl]-1,2-oxazole-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.