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Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate
TL;DR: Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate (CAS 339283-92-0) is a chemical compound with molecular formula C13H12O5 and molecular weight 248.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(3-acetyl-1-benzofuran-5-yl)oxy]acetate
Also Known As: methyl 2-((3-acetylbenzofuran-5-yl)oxy)acetate, methyl 2-[(3-acetyl-1-benzofuran-5-yl)oxy]acetate, Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate, methyl 2-(3-acetylbenzo[b]furan-5-yloxy)acetate, Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate #
| Molecular Formula | C13H12O5 |
|---|---|
| Molecular Weight | 248.07 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 65.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 248.06847 |
| Heavy Atoms | 18 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 339283-92-0 |
|---|---|
| SMILES | CC(=O)C1=COC2=C1C=C(C=C2)OCC(=O)OC |
| InChIKey | XADGLWVTZIGJQN-UHFFFAOYSA-N |
Product Overview
Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate (CAS 339283-92-0), with molecular formula C13H12O5 and molecular weight 248.07 g/mol. IUPAC: methyl 2-[(3-acetyl-1-benzofuran-5-yl)oxy]acetate.
Chemical Property Profile of Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate
Property Insights of Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate. The TPSA of 65.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate. Following Lipinski's Rule of Five, Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate has 0 hydrogen bond donor(s) and 5 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 Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate?
The CAS number of Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate is 339283-92-0.
What is the molecular formula of Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate?
The molecular formula of Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate is C13H12O5.
What is the molecular weight of Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate?
The molecular weight of Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate is 248.07 g/mol.
Where can I buy Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate?
You can request a quote for Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl [(3-acetyl-1-benzofuran-5-yl)oxy]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.