2-(2-Phenyl-1,3-benzoxazol-7-yl)propanoic acid
TL;DR: 2-(2-Phenyl-1,3-benzoxazol-7-yl)propanoic acid (CAS 60723-71-9) is a chemical compound with molecular formula C16H13NO3 and molecular weight 267.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-phenyl-1,3-benzoxazol-7-yl)propanoic acid
Also Known As: alpha-Methyl-2-phenyl-7-benzoxazoleacetic acid, 2-(2-phenyl-1,3-benzoxazol-7-yl)propanoic acid, 7-BENZOXAZOLEACETIC ACID, alpha-METHYL-2-PHENYL-, 7-Benzoxazoleacetic acid, .alpha.-methyl-2-phenyl-, RefChem:1060936
| Molecular Formula | C16H13NO3 |
|---|---|
| Molecular Weight | 267.09 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.08954 |
| Heavy Atoms | 20 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 60723-71-9 |
|---|---|
| SMILES | CC(C1=C2C(=CC=C1)N=C(O2)C3=CC=CC=C3)C(=O)O |
| InChIKey | NHWQKXLYPPATQO-UHFFFAOYSA-N |
Product Overview
2-(2-Phenyl-1,3-benzoxazol-7-yl)propanoic acid (CAS 60723-71-9), with molecular formula C16H13NO3 and molecular weight 267.09 g/mol. IUPAC: 2-(2-phenyl-1,3-benzoxazol-7-yl)propanoic acid.
Chemical Property Profile of 2-(2-Phenyl-1,3-benzoxazol-7-yl)propanoic acid
Property Insights of 2-(2-Phenyl-1,3-benzoxazol-7-yl)propanoic acid
The XLogP value of 3.5 indicates that 2-(2-Phenyl-1,3-benzoxazol-7-yl)propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Phenyl-1,3-benzoxazol-7-yl)propanoic acid. Following Lipinski's Rule of Five, 2-(2-Phenyl-1,3-benzoxazol-7-yl)propanoic acid has 1 hydrogen bond donor(s) and 4 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-Phenyl-1,3-benzoxazol-7-yl)propanoic acid?
The CAS number of 2-(2-Phenyl-1,3-benzoxazol-7-yl)propanoic acid is 60723-71-9.
What is the molecular formula of 2-(2-Phenyl-1,3-benzoxazol-7-yl)propanoic acid?
The molecular formula of 2-(2-Phenyl-1,3-benzoxazol-7-yl)propanoic acid is C16H13NO3.
What is the molecular weight of 2-(2-Phenyl-1,3-benzoxazol-7-yl)propanoic acid?
The molecular weight of 2-(2-Phenyl-1,3-benzoxazol-7-yl)propanoic acid is 267.09 g/mol.
Where can I buy 2-(2-Phenyl-1,3-benzoxazol-7-yl)propanoic acid?
You can request a quote for 2-(2-Phenyl-1,3-benzoxazol-7-yl)propanoic 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-Phenyl-1,3-benzoxazol-7-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Phenyl-1,3-benzoxazol-7-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.