4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione
TL;DR: 4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione (CAS 89586-40-3) is a chemical compound with molecular formula C10H7NO6 and molecular weight 237.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione
Also Known As: 4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione, 4-Methoxy-6-methyl-5-nitroisobenzofuran-1,3-dione, 1,3-Isobenzofurandione, 4-methoxy-6-methyl-5-nitro-, 4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione #, RefChem:293902
| Molecular Formula | C10H7NO6 |
|---|---|
| Molecular Weight | 237.03 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 98.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 237.02734 |
| Heavy Atoms | 17 |
| Complexity | 375.0 |
Chemical Identifiers
| CAS Number | 89586-40-3 |
|---|---|
| SMILES | CC1=CC2=C(C(=C1[N+](=O)[O-])OC)C(=O)OC2=O |
| InChIKey | IARXUSZUQRPXOT-UHFFFAOYSA-N |
Product Overview
4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione (CAS 89586-40-3), with molecular formula C10H7NO6 and molecular weight 237.03 g/mol. IUPAC: 4-methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione.
Chemical Property Profile of 4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione
Property Insights of 4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione. The TPSA of 98.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione. Following Lipinski's Rule of Five, 4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione has 0 hydrogen bond donor(s) and 6 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 4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione?
The CAS number of 4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione is 89586-40-3.
What is the molecular formula of 4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione?
The molecular formula of 4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione is C10H7NO6.
What is the molecular weight of 4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione?
The molecular weight of 4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione is 237.03 g/mol.
Where can I buy 4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione?
You can request a quote for 4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxy-6-methyl-5-nitro-2-benzofuran-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.