5-Methoxybenzofurazan 3-oxide
TL;DR: 5-Methoxybenzofurazan 3-oxide (CAS 3524-06-9) is a chemical compound with molecular formula C7H6N2O3 and molecular weight 166.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methoxy-3-oxido-2,1,3-benzoxadiazol-3-ium
Also Known As: 5-Methoxybenzofurazan 3-oxide, 5-Methoxybenzofurazane 3-oxide, 6-Methoxybenzofurazane 1-oxide, 5-METHOXYBENZOFURAZAN-3-OXIDE, 5-methoxy-3-oxido-2,1,3-benzoxadiazol-3-ium
| Molecular Formula | C7H6N2O3 |
|---|---|
| Molecular Weight | 166.04 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 166.03784 |
| Heavy Atoms | 12 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 3524-06-9 |
|---|---|
| SMILES | COC1=CC2=[N+](ON=C2C=C1)[O-] |
| InChIKey | XCWFKHHSXPIDHN-UHFFFAOYSA-N |
Product Overview
5-Methoxybenzofurazan 3-oxide (CAS 3524-06-9), with molecular formula C7H6N2O3 and molecular weight 166.04 g/mol. IUPAC: 5-methoxy-3-oxido-2,1,3-benzoxadiazol-3-ium.
Chemical Property Profile of 5-Methoxybenzofurazan 3-oxide
Property Insights of 5-Methoxybenzofurazan 3-oxide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methoxybenzofurazan 3-oxide. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Methoxybenzofurazan 3-oxide. Following Lipinski's Rule of Five, 5-Methoxybenzofurazan 3-oxide 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 5-Methoxybenzofurazan 3-oxide?
The CAS number of 5-Methoxybenzofurazan 3-oxide is 3524-06-9.
What is the molecular formula of 5-Methoxybenzofurazan 3-oxide?
The molecular formula of 5-Methoxybenzofurazan 3-oxide is C7H6N2O3.
What is the molecular weight of 5-Methoxybenzofurazan 3-oxide?
The molecular weight of 5-Methoxybenzofurazan 3-oxide is 166.04 g/mol.
Where can I buy 5-Methoxybenzofurazan 3-oxide?
You can request a quote for 5-Methoxybenzofurazan 3-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methoxybenzofurazan 3-oxide?
Yes, KEHONG BIO provides custom synthesis services for 5-Methoxybenzofurazan 3-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.