2-Acetyl-7-hydroxybenzofuran
TL;DR: 2-Acetyl-7-hydroxybenzofuran (CAS 40020-87-9) is a chemical compound with molecular formula C10H8O3 and molecular weight 176.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(7-hydroxy-1-benzofuran-2-yl)ethanone
Also Known As: 2-Acetyl-7-hydroxybenzofuran, 1-(7-hydroxybenzofuran-2-yl)ethanone, 2-Acetylbenzofuran-7-ol, 2-Acetyl-7-hydroxycoumarone, 1-(7-Hydroxy-1-benzofuran-2-yl)ethanone
| Molecular Formula | C10H8O3 |
|---|---|
| Molecular Weight | 176.05 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.04735 |
| Heavy Atoms | 13 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 40020-87-9 |
|---|---|
| SMILES | CC(=O)C1=CC2=C(O1)C(=CC=C2)O |
| InChIKey | HRIVIHCUSKDPNK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Acetyl-7-hydroxybenzofuran (CAS 40020-87-9), with molecular formula C10H8O3 and molecular weight 176.05 g/mol. IUPAC: 1-(7-hydroxy-1-benzofuran-2-yl)ethanone.
Chemical Property Profile of 2-Acetyl-7-hydroxybenzofuran
Property Insights of 2-Acetyl-7-hydroxybenzofuran
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Acetyl-7-hydroxybenzofuran. With a topological polar surface area (TPSA) of 50.4 Ų, 2-Acetyl-7-hydroxybenzofuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Acetyl-7-hydroxybenzofuran 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 2-Acetyl-7-hydroxybenzofuran?
The CAS number of 2-Acetyl-7-hydroxybenzofuran is 40020-87-9.
What is the molecular formula of 2-Acetyl-7-hydroxybenzofuran?
The molecular formula of 2-Acetyl-7-hydroxybenzofuran is C10H8O3.
What is the molecular weight of 2-Acetyl-7-hydroxybenzofuran?
The molecular weight of 2-Acetyl-7-hydroxybenzofuran is 176.05 g/mol.
Where can I buy 2-Acetyl-7-hydroxybenzofuran?
You can request a quote for 2-Acetyl-7-hydroxybenzofuran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Acetyl-7-hydroxybenzofuran?
Yes, KEHONG BIO provides custom synthesis services for 2-Acetyl-7-hydroxybenzofuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.