Benzofuroxan
TL;DR: Benzofuroxan (CAS 480-96-6) is a chemical compound with molecular formula C6H4N2O2 and molecular weight 136.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-oxido-2,1,3-benzoxadiazol-3-ium
Also Known As: Benzofuroxan, Benzofuroxane, Benzofurazan 1-oxide, Benzofurazan oxide, 2,1,3-Benzoxadiazole 1-oxide
| Molecular Formula | C6H4N2O2 |
|---|---|
| Molecular Weight | 136.03 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 51.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 136.02728 |
| Heavy Atoms | 10 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 480-96-6 |
|---|---|
| SMILES | C1=CC2=NO[N+](=C2C=C1)[O-] |
| InChIKey | OKEAMBAZBICIFP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzofuroxan (CAS 480-96-6), with molecular formula C6H4N2O2 and molecular weight 136.03 g/mol. IUPAC: 3-oxido-2,1,3-benzoxadiazol-3-ium.
Chemical Property Profile of Benzofuroxan
Property Insights of Benzofuroxan
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzofuroxan. With a topological polar surface area (TPSA) of 51.5 Ų, Benzofuroxan exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzofuroxan has 0 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 Benzofuroxan?
The CAS number of Benzofuroxan is 480-96-6.
What is the molecular formula of Benzofuroxan?
The molecular formula of Benzofuroxan is C6H4N2O2.
What is the molecular weight of Benzofuroxan?
The molecular weight of Benzofuroxan is 136.03 g/mol.
Where can I buy Benzofuroxan?
You can request a quote for Benzofuroxan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzofuroxan?
Yes, KEHONG BIO provides custom synthesis services for Benzofuroxan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.