[2-[(5-Methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate
TL;DR: [2-[(5-Methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate (CAS 5287-53-6) is a chemical compound with molecular formula C16H12O5 and molecular weight 284.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(5-methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate
Also Known As: [2-[(5-methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate|2-[(5-Methylfuran-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl acetate
| Molecular Formula | C16H12O5 |
|---|---|
| Molecular Weight | 284.07 g/mol |
| LogP | 3.12952 |
| Topological Polar Surface Area | 65.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.06848 |
| Heavy Atoms | 21 |
| Complexity | 766.72455 |
Chemical Identifiers
| CAS Number | 5287-53-6 |
|---|---|
| SMILES | CC1=CC=C(O1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C |
Product Overview
[2-[(5-Methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate (CAS 5287-53-6), with molecular formula C16H12O5 and molecular weight 284.07 g/mol. IUPAC: [2-[(5-methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate.
Chemical Property Profile of [2-[(5-Methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate
Property Insights of [2-[(5-Methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate
The XLogP value of 3.12952 indicates that [2-[(5-Methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.74 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-[(5-Methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate. Following Lipinski's Rule of Five, [2-[(5-Methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] 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 [2-[(5-Methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate?
The CAS number of [2-[(5-Methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate is 5287-53-6.
What is the molecular formula of [2-[(5-Methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate?
The molecular formula of [2-[(5-Methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate is C16H12O5.
What is the molecular weight of [2-[(5-Methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate?
The molecular weight of [2-[(5-Methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate is 284.07 g/mol.
Where can I buy [2-[(5-Methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate?
You can request a quote for [2-[(5-Methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-[(5-Methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate?
Yes, KEHONG BIO provides custom synthesis services for [2-[(5-Methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.