Benzo[g][2,1,3]benzoxadiazol-8-yl acetate
TL;DR: Benzo[g][2,1,3]benzoxadiazol-8-yl acetate (CAS 137345-63-2) is a chemical compound with molecular formula C12H8N2O3 and molecular weight 228.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzo[g][2,1,3]benzoxadiazol-8-yl acetate
Also Known As: 7-acetoxy-1,2-naphthofurazan, benzo[g][2,1,3]benzoxadiazol-8-yl acetate, Naphth[1,2-c][1,2,5]oxadiazol-8-ol, 8-acetate
| Molecular Formula | C12H8N2O3 |
|---|---|
| Molecular Weight | 228.05 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 65.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.0535 |
| Heavy Atoms | 17 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 137345-63-2 |
|---|---|
| SMILES | CC(=O)OC1=CC2=C(C=C1)C=CC3=NON=C32 |
| InChIKey | QBEYNYIOQZWDCR-UHFFFAOYSA-N |
Product Overview
Benzo[g][2,1,3]benzoxadiazol-8-yl acetate (CAS 137345-63-2), with molecular formula C12H8N2O3 and molecular weight 228.05 g/mol. IUPAC: benzo[g][2,1,3]benzoxadiazol-8-yl acetate.
Chemical Property Profile of Benzo[g][2,1,3]benzoxadiazol-8-yl acetate
Property Insights of Benzo[g][2,1,3]benzoxadiazol-8-yl acetate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzo[g][2,1,3]benzoxadiazol-8-yl acetate. The TPSA of 65.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzo[g][2,1,3]benzoxadiazol-8-yl acetate. Following Lipinski's Rule of Five, Benzo[g][2,1,3]benzoxadiazol-8-yl acetate has 0 hydrogen bond donor(s) and 5 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 Benzo[g][2,1,3]benzoxadiazol-8-yl acetate?
The CAS number of Benzo[g][2,1,3]benzoxadiazol-8-yl acetate is 137345-63-2.
What is the molecular formula of Benzo[g][2,1,3]benzoxadiazol-8-yl acetate?
The molecular formula of Benzo[g][2,1,3]benzoxadiazol-8-yl acetate is C12H8N2O3.
What is the molecular weight of Benzo[g][2,1,3]benzoxadiazol-8-yl acetate?
The molecular weight of Benzo[g][2,1,3]benzoxadiazol-8-yl acetate is 228.05 g/mol.
Where can I buy Benzo[g][2,1,3]benzoxadiazol-8-yl acetate?
You can request a quote for Benzo[g][2,1,3]benzoxadiazol-8-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo[g][2,1,3]benzoxadiazol-8-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for Benzo[g][2,1,3]benzoxadiazol-8-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.