![(E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide structure](/static/products/352/352647-68-8.png)
(E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide
TL;DR: (E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide (CAS 352647-68-8) is a chemical compound with molecular formula C8H5N3O5 and molecular weight 223.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-(1-oxido-4-oxo-2,1,3-benzoxadiazol-1-ium-5-ylidene)amino] acetate
Also Known As: (E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide, 5-[(acetyloxy)imino]-2,1,3-benzoxadiazol-4(5H)-one 1-oxide, [(E)-(1-oxido-4-oxo-2,1,3-benzoxadiazol-1-ium-5-ylidene)amino] acetate
| Molecular Formula | C8H5N3O5 |
|---|---|
| Molecular Weight | 223.02 g/mol |
| LogP | -0.5634 |
| Topological Polar Surface Area | 108.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 223.02292 |
| Heavy Atoms | 16 |
| Complexity | 527.7761 |
Chemical Identifiers
| CAS Number | 352647-68-8 |
|---|---|
| SMILES | CC(=O)O/N=C/1\C=CC2=[N+](ON=C2C1=O)[O-] |
Product Overview
(E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide (CAS 352647-68-8), with molecular formula C8H5N3O5 and molecular weight 223.02 g/mol. IUPAC: [(E)-(1-oxido-4-oxo-2,1,3-benzoxadiazol-1-ium-5-ylidene)amino] acetate.
Chemical Property Profile of (E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide
Property Insights of (E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide
The XLogP value of -0.5634 indicates that (E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 108.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide. Following Lipinski's Rule of Five, (E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide has 0 hydrogen bond donor(s) and 7 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 (E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide?
The CAS number of (E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide is 352647-68-8.
What is the molecular formula of (E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide?
The molecular formula of (E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide is C8H5N3O5.
What is the molecular weight of (E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide?
The molecular weight of (E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide is 223.02 g/mol.
Where can I buy (E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide?
You can request a quote for (E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-(acetoxyimino)-4-oxo-4,5-dihydrobenzo[c][1,2,5]oxadiazole 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.