![1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one structure](/static/products/1040/104085-99-6.webp)
1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one
TL;DR: 1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one (CAS 104085-99-6) is a chemical compound with molecular formula C17H14O3 and molecular weight 266.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one
Also Known As: KST-1A9678, 1-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one, 3-Propionyl-2-<4-hydroxy-phenyl>-cumaron, 2-(4-hydroxy-phenyl)-3-propionylbenzofuran, 1-(2-(4-Hydroxyphenyl)benzofuran-3-yl)propan-1-one
| Molecular Formula | C17H14O3 |
|---|---|
| Molecular Weight | 266.09 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.0943 |
| Heavy Atoms | 20 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 104085-99-6 |
|---|---|
| SMILES | CCC(=O)C1=C(OC2=CC=CC=C21)C3=CC=C(C=C3)O |
| InChIKey | RVUNLVRIKTUGCA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one (CAS 104085-99-6), with molecular formula C17H14O3 and molecular weight 266.09 g/mol. IUPAC: 1-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one.
Chemical Property Profile of 1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one
Property Insights of 1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one
The XLogP value of 3.8 indicates that 1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.4 Ų, 1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one has 1 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 1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one?
The CAS number of 1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one is 104085-99-6.
What is the molecular formula of 1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one?
The molecular formula of 1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one is C17H14O3.
What is the molecular weight of 1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one?
The molecular weight of 1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one is 266.09 g/mol.
Where can I buy 1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one?
You can request a quote for 1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]propan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.