3-(1,3-Benzoxazol-2-yl)propanoic acid
TL;DR: 3-(1,3-Benzoxazol-2-yl)propanoic acid (CAS 78757-00-3) is a chemical compound with molecular formula C10H9NO3 and molecular weight 191.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzoxazol-2-yl)propanoic acid
Also Known As: 3-(1,3-benzoxazol-2-yl)propanoic acid, 3-(Benzo[d]oxazol-2-yl)propanoic acid, 2-Benzoxazolepropanoic acid, 2-Benzoxazolepropanoicacid, 2-Propanesulfonyl chloride
| Molecular Formula | C10H9NO3 |
|---|---|
| Molecular Weight | 191.06 g/mol |
| LogP | 1.845 |
| Topological Polar Surface Area | 63.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 191.05824 |
| Heavy Atoms | 14 |
| Complexity | 428.08997 |
Chemical Identifiers
| CAS Number | 78757-00-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(O2)CCC(=O)O |
Product Overview
3-(1,3-Benzoxazol-2-yl)propanoic acid (CAS 78757-00-3), with molecular formula C10H9NO3 and molecular weight 191.06 g/mol. IUPAC: 3-(1,3-benzoxazol-2-yl)propanoic acid.
Chemical Property Profile of 3-(1,3-Benzoxazol-2-yl)propanoic acid
Property Insights of 3-(1,3-Benzoxazol-2-yl)propanoic acid
The XLogP value of 1.845 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1,3-Benzoxazol-2-yl)propanoic acid. The TPSA of 63.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1,3-Benzoxazol-2-yl)propanoic acid. Following Lipinski's Rule of Five, 3-(1,3-Benzoxazol-2-yl)propanoic 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-(1,3-Benzoxazol-2-yl)propanoic acid?
The CAS number of 3-(1,3-Benzoxazol-2-yl)propanoic acid is 78757-00-3.
What is the molecular formula of 3-(1,3-Benzoxazol-2-yl)propanoic acid?
The molecular formula of 3-(1,3-Benzoxazol-2-yl)propanoic acid is C10H9NO3.
What is the molecular weight of 3-(1,3-Benzoxazol-2-yl)propanoic acid?
The molecular weight of 3-(1,3-Benzoxazol-2-yl)propanoic acid is 191.06 g/mol.
Where can I buy 3-(1,3-Benzoxazol-2-yl)propanoic acid?
You can request a quote for 3-(1,3-Benzoxazol-2-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 3-(1,3-Benzoxazol-2-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,3-Benzoxazol-2-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.