3-(1-Benzofuran-2-yl)propanoate
TL;DR: 3-(1-Benzofuran-2-yl)propanoate (CAS 21683-86-3) is a chemical compound with molecular formula C11H9O3- and molecular weight 189.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-benzofuran-2-yl)propanoate
Also Known As: 3-(1-benzofuran-2-yl)propanoate
| Molecular Formula | C11H9O3- |
|---|---|
| Molecular Weight | 189.06 g/mol |
| LogP | 1.1153 |
| Topological Polar Surface Area | 53.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 189.05518 |
| Heavy Atoms | 14 |
| Complexity | 423.25552 |
Chemical Identifiers
| CAS Number | 21683-86-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(O2)CCC(=O)[O-] |
Product Overview
3-(1-Benzofuran-2-yl)propanoate (CAS 21683-86-3), with molecular formula C11H9O3- and molecular weight 189.06 g/mol. IUPAC: 3-(1-benzofuran-2-yl)propanoate.
Chemical Property Profile of 3-(1-Benzofuran-2-yl)propanoate
Property Insights of 3-(1-Benzofuran-2-yl)propanoate
The XLogP value of 1.1153 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1-Benzofuran-2-yl)propanoate. With a topological polar surface area (TPSA) of 53.27 Ų, 3-(1-Benzofuran-2-yl)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1-Benzofuran-2-yl)propanoate has 0 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-Benzofuran-2-yl)propanoate?
The CAS number of 3-(1-Benzofuran-2-yl)propanoate is 21683-86-3.
What is the molecular formula of 3-(1-Benzofuran-2-yl)propanoate?
The molecular formula of 3-(1-Benzofuran-2-yl)propanoate is C11H9O3-.
What is the molecular weight of 3-(1-Benzofuran-2-yl)propanoate?
The molecular weight of 3-(1-Benzofuran-2-yl)propanoate is 189.06 g/mol.
Where can I buy 3-(1-Benzofuran-2-yl)propanoate?
You can request a quote for 3-(1-Benzofuran-2-yl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1-Benzofuran-2-yl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for 3-(1-Benzofuran-2-yl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.