![3-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one structure](/static/products/342/34279-11-3.png)
3-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one
TL;DR: 3-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one (CAS 34279-11-3) is a chemical compound with molecular formula C16H12O3 and molecular weight 252.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3Z)-3-[(4-methylphenoxy)methylidene]-2-benzofuran-1-one
Also Known As: 3-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one, 3-[(4-methylphenoxy)methylene]isobenzofuran-1-one, AJ-078/36985003, (3Z)-3-[(4-methylphenoxy)methylidene]-2-benzofuran-1-one, 3-[1-p-Tolyloxy-meth-(Z)-ylidene]-3H-isobenzofuran-1-one
| Molecular Formula | C16H12O3 |
|---|---|
| Molecular Weight | 252.08 g/mol |
| LogP | 3.54282 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 252.07864 |
| Heavy Atoms | 19 |
| Complexity | 653.9492 |
Chemical Identifiers
| CAS Number | 34279-11-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)O/C=C\2/C3=CC=CC=C3C(=O)O2 |
Product Overview
3-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one (CAS 34279-11-3), with molecular formula C16H12O3 and molecular weight 252.08 g/mol. IUPAC: (3Z)-3-[(4-methylphenoxy)methylidene]-2-benzofuran-1-one.
Chemical Property Profile of 3-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one
Property Insights of 3-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one
The XLogP value of 3.54282 indicates that 3-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 3-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one 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-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one?
The CAS number of 3-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one is 34279-11-3.
What is the molecular formula of 3-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one?
The molecular formula of 3-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one is C16H12O3.
What is the molecular weight of 3-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one?
The molecular weight of 3-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one is 252.08 g/mol.
Where can I buy 3-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one?
You can request a quote for 3-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-methylphenoxy)methylene]-2-benzofuran-1(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.