![3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one structure](/static/products/6957/69574-13-6.webp)
3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one
TL;DR: 3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one (CAS 69574-13-6) is a chemical compound with molecular formula C23H26O3 and molecular weight 350.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one
Also Known As: (3E)-3-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-2-ben, 3-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one
| Molecular Formula | C23H26O3 |
|---|---|
| Molecular Weight | 350.19 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 350.1882 |
| Heavy Atoms | 26 |
| Complexity | 539.0 |
Chemical Identifiers
| CAS Number | 69574-13-6 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=C2C3=CC=CC=C3C(=O)O2 |
| InChIKey | VRABXUCLXRDXJQ-UHFFFAOYSA-N |
Product Overview
3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one (CAS 69574-13-6), with molecular formula C23H26O3 and molecular weight 350.19 g/mol. IUPAC: 3-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one.
Chemical Property Profile of 3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one
Property Insights of 3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one
The XLogP value of 6.5 indicates that 3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one?
The CAS number of 3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one is 69574-13-6.
What is the molecular formula of 3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one?
The molecular formula of 3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one is C23H26O3.
What is the molecular weight of 3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one?
The molecular weight of 3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one is 350.19 g/mol.
Where can I buy 3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one?
You can request a quote for 3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-2-benzofuran-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.