(2Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one
TL;DR: (2Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one (CAS 879807-07-5) is a chemical compound with molecular formula C18H12ClFO4 and molecular weight 346.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-[(2-chloro-6-fluorophenyl)methylidene]-6-(2-oxopropoxy)-1-benzofuran-3-one
Also Known As: (2Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one, (2Z)-2-[(2-chloro-6-fluorophenyl)methylidene]-6-(2-oxopropoxy)-1-benzofuran-3-one, (Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)benzofuran-3(2H)-one
| Molecular Formula | C18H12ClFO4 |
|---|---|
| Molecular Weight | 346.04 g/mol |
| LogP | 4.0631 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 346.0408 |
| Heavy Atoms | 24 |
| Complexity | 853.0676 |
Chemical Identifiers
| CAS Number | 879807-07-5 |
|---|---|
| SMILES | CC(=O)COC1=CC2=C(C=C1)C(=O)/C(=C/C3=C(C=CC=C3Cl)F)/O2 |
Product Overview
(2Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one (CAS 879807-07-5), with molecular formula C18H12ClFO4 and molecular weight 346.04 g/mol. IUPAC: (2Z)-2-[(2-chloro-6-fluorophenyl)methylidene]-6-(2-oxopropoxy)-1-benzofuran-3-one.
Chemical Property Profile of (2Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one
Property Insights of (2Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one
The XLogP value of 4.0631 indicates that (2Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, (2Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one 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 (2Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one?
The CAS number of (2Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one is 879807-07-5.
What is the molecular formula of (2Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one?
The molecular formula of (2Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one is C18H12ClFO4.
What is the molecular weight of (2Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one?
The molecular weight of (2Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one is 346.04 g/mol.
Where can I buy (2Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one?
You can request a quote for (2Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for (2Z)-2-(2-chloro-6-fluorobenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.