6-Methoxy-2-methyl-4,7-benzofurandione
TL;DR: 6-Methoxy-2-methyl-4,7-benzofurandione (CAS 74161-27-6) is a chemical compound with molecular formula C10H8O4 and molecular weight 192.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methoxy-2-methyl-1-benzofuran-4,7-dione
Also Known As: Acamelin, 6-methoxy-2-methyl-1-benzofuran-4,7-dione, 2-Methyl-6-methoxy-4,7-benzofurandione, 6-Methoxy-2-methyl-4,7-benzofurandione, 2-methyl-6-methoxy-furano-benzoquinone
| Molecular Formula | C10H8O4 |
|---|---|
| Molecular Weight | 192.04 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 56.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.04225 |
| Heavy Atoms | 14 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 74161-27-6 |
|---|---|
| SMILES | CC1=CC2=C(O1)C(=O)C(=CC2=O)OC |
| InChIKey | DNQLVCZXYPFUHF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Methoxy-2-methyl-4,7-benzofurandione (CAS 74161-27-6), with molecular formula C10H8O4 and molecular weight 192.04 g/mol. IUPAC: 6-methoxy-2-methyl-1-benzofuran-4,7-dione.
Chemical Property Profile of 6-Methoxy-2-methyl-4,7-benzofurandione
Property Insights of 6-Methoxy-2-methyl-4,7-benzofurandione
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methoxy-2-methyl-4,7-benzofurandione. With a topological polar surface area (TPSA) of 56.5 Ų, 6-Methoxy-2-methyl-4,7-benzofurandione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methoxy-2-methyl-4,7-benzofurandione 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 6-Methoxy-2-methyl-4,7-benzofurandione?
The CAS number of 6-Methoxy-2-methyl-4,7-benzofurandione is 74161-27-6.
What is the molecular formula of 6-Methoxy-2-methyl-4,7-benzofurandione?
The molecular formula of 6-Methoxy-2-methyl-4,7-benzofurandione is C10H8O4.
What is the molecular weight of 6-Methoxy-2-methyl-4,7-benzofurandione?
The molecular weight of 6-Methoxy-2-methyl-4,7-benzofurandione is 192.04 g/mol.
Where can I buy 6-Methoxy-2-methyl-4,7-benzofurandione?
You can request a quote for 6-Methoxy-2-methyl-4,7-benzofurandione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methoxy-2-methyl-4,7-benzofurandione?
Yes, KEHONG BIO provides custom synthesis services for 6-Methoxy-2-methyl-4,7-benzofurandione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.