2-(2-Ethyl-1,3-benzoxazol-5-yl)acetic acid
TL;DR: 2-(2-Ethyl-1,3-benzoxazol-5-yl)acetic acid (CAS 866038-38-2) is a chemical compound with molecular formula C11H11NO3 and molecular weight 205.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-ethyl-1,3-benzoxazol-5-yl)acetic acid
Also Known As: 2-(2-ethyl-1,3-benzoxazol-5-yl)acetic acid, Bionet2_001495, 2-(2-ethylbenzo[d]oxazol-5-yl)acetic acid, 2-Ethylbenzo[d]oxazole-5-acetic acid, (2-ethyl-1,3-benzoxazol-5-yl)acetic acid
| Molecular Formula | C11H11NO3 |
|---|---|
| Molecular Weight | 205.07 g/mol |
| LogP | 2.0173 |
| Topological Polar Surface Area | 63.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 205.0739 |
| Heavy Atoms | 15 |
| Complexity | 501.50238 |
Chemical Identifiers
| CAS Number | 866038-38-2 |
|---|---|
| SMILES | CCC1=NC2=C(O1)C=CC(=C2)CC(=O)O |
Product Overview
2-(2-Ethyl-1,3-benzoxazol-5-yl)acetic acid (CAS 866038-38-2), with molecular formula C11H11NO3 and molecular weight 205.07 g/mol. IUPAC: 2-(2-ethyl-1,3-benzoxazol-5-yl)acetic acid.
Chemical Property Profile of 2-(2-Ethyl-1,3-benzoxazol-5-yl)acetic acid
Property Insights of 2-(2-Ethyl-1,3-benzoxazol-5-yl)acetic acid
The XLogP value of 2.0173 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Ethyl-1,3-benzoxazol-5-yl)acetic acid. The TPSA of 63.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Ethyl-1,3-benzoxazol-5-yl)acetic acid. Following Lipinski's Rule of Five, 2-(2-Ethyl-1,3-benzoxazol-5-yl)acetic 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 2-(2-Ethyl-1,3-benzoxazol-5-yl)acetic acid?
The CAS number of 2-(2-Ethyl-1,3-benzoxazol-5-yl)acetic acid is 866038-38-2.
What is the molecular formula of 2-(2-Ethyl-1,3-benzoxazol-5-yl)acetic acid?
The molecular formula of 2-(2-Ethyl-1,3-benzoxazol-5-yl)acetic acid is C11H11NO3.
What is the molecular weight of 2-(2-Ethyl-1,3-benzoxazol-5-yl)acetic acid?
The molecular weight of 2-(2-Ethyl-1,3-benzoxazol-5-yl)acetic acid is 205.07 g/mol.
Where can I buy 2-(2-Ethyl-1,3-benzoxazol-5-yl)acetic acid?
You can request a quote for 2-(2-Ethyl-1,3-benzoxazol-5-yl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Ethyl-1,3-benzoxazol-5-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Ethyl-1,3-benzoxazol-5-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.