3-(3,4-dimethoxybenzylidene)-2-benzofuran-1(3H)-one
TL;DR: 3-(3,4-dimethoxybenzylidene)-2-benzofuran-1(3H)-one (CAS 148345-07-7) is a chemical compound with molecular formula C17H14O4 and molecular weight 282.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3Z)-3-[(3,4-dimethoxyphenyl)methylidene]-2-benzofuran-1-one
Also Known As: 3-(3,4-Dimethoxybenzylidene)phthalide, BAS 00187775, 3-(3,4-dimethoxybenzylidene)-2-benzofuran-1(3H)-one, J1.190.543I, (Z)-3-(3,4-Dimethoxybenzylidene)isobenzofuran-1(3H)-one
| Molecular Formula | C17H14O4 |
|---|---|
| Molecular Weight | 282.09 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.0892 |
| Heavy Atoms | 21 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 148345-07-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=C\2/C3=CC=CC=C3C(=O)O2)OC |
| InChIKey | RPYYTHUJKJTHOE-DHDCSXOGSA-N |
Product Overview
3-(3,4-dimethoxybenzylidene)-2-benzofuran-1(3H)-one (CAS 148345-07-7), with molecular formula C17H14O4 and molecular weight 282.09 g/mol. IUPAC: (3Z)-3-[(3,4-dimethoxyphenyl)methylidene]-2-benzofuran-1-one.
Chemical Property Profile of 3-(3,4-dimethoxybenzylidene)-2-benzofuran-1(3H)-one
Property Insights of 3-(3,4-dimethoxybenzylidene)-2-benzofuran-1(3H)-one
The XLogP value of 3.4 indicates that 3-(3,4-dimethoxybenzylidene)-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 44.8 Ų, 3-(3,4-dimethoxybenzylidene)-2-benzofuran-1(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3,4-dimethoxybenzylidene)-2-benzofuran-1(3H)-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 3-(3,4-dimethoxybenzylidene)-2-benzofuran-1(3H)-one?
The CAS number of 3-(3,4-dimethoxybenzylidene)-2-benzofuran-1(3H)-one is 148345-07-7.
What is the molecular formula of 3-(3,4-dimethoxybenzylidene)-2-benzofuran-1(3H)-one?
The molecular formula of 3-(3,4-dimethoxybenzylidene)-2-benzofuran-1(3H)-one is C17H14O4.
What is the molecular weight of 3-(3,4-dimethoxybenzylidene)-2-benzofuran-1(3H)-one?
The molecular weight of 3-(3,4-dimethoxybenzylidene)-2-benzofuran-1(3H)-one is 282.09 g/mol.
Where can I buy 3-(3,4-dimethoxybenzylidene)-2-benzofuran-1(3H)-one?
You can request a quote for 3-(3,4-dimethoxybenzylidene)-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-(3,4-dimethoxybenzylidene)-2-benzofuran-1(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,4-dimethoxybenzylidene)-2-benzofuran-1(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.