![({2-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile structure](/static/products/7048/7048-52-4.webp)
({2-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile
TL;DR: ({2-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile (CAS 7048-52-4) is a chemical compound with molecular formula C17H10FNO3 and molecular weight 295.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-[(4-fluorophenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetonitrile
Also Known As: ({2-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile, 2-[2-[(4-fluorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxyacetonitrile, 2-[[2-[(4-fluorophenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetonitrile
| Molecular Formula | C17H10FNO3 |
|---|---|
| Molecular Weight | 295.06 g/mol |
| LogP | 3.34428 |
| Topological Polar Surface Area | 59.32 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.06448 |
| Heavy Atoms | 22 |
| Complexity | 803.64404 |
Chemical Identifiers
| CAS Number | 7048-52-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C=C2C(=O)C3=C(O2)C=C(C=C3)OCC#N)F |
Product Overview
({2-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile (CAS 7048-52-4), with molecular formula C17H10FNO3 and molecular weight 295.06 g/mol. IUPAC: 2-[[2-[(4-fluorophenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetonitrile.
Chemical Property Profile of ({2-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile
Property Insights of ({2-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile
The XLogP value of 3.34428 indicates that ({2-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.32 Ų, ({2-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ({2-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile has 0 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-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile?
The CAS number of ({2-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile is 7048-52-4.
What is the molecular formula of ({2-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile?
The molecular formula of ({2-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile is C17H10FNO3.
What is the molecular weight of ({2-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile?
The molecular weight of ({2-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile is 295.06 g/mol.
Where can I buy ({2-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile?
You can request a quote for ({2-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ({2-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for ({2-[(4-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.