![6-Carboxybenzo[c][1,2,5]oxadiazole 1-oxide structure](/static/products/607/60741-56-2.png)
6-Carboxybenzo[c][1,2,5]oxadiazole 1-oxide
TL;DR: 6-Carboxybenzo[c][1,2,5]oxadiazole 1-oxide (CAS 60741-56-2) is a chemical compound with molecular formula C7H4N2O4 and molecular weight 180.02 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-5-carboxylic acid
Also Known As: 6-Carboxybenzofurazane 1-oxide, 6-carboxybenzo[c][1,2,5]oxadiazole 1-oxide, J1.625.212C, 6-CARBOXY-2,1,3-BENZOXADIAZOL-1-IUM-1-OLATE, 2,1,3-Benzoxadiazole-5-carboxylic acid, 3-oxide
| Molecular Formula | C7H4N2O4 |
|---|---|
| Molecular Weight | 180.02 g/mol |
| LogP | 0.1594 |
| Topological Polar Surface Area | 90.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.0171 |
| Heavy Atoms | 13 |
| Complexity | 476.29733 |
Chemical Identifiers
| CAS Number | 60741-56-2 |
|---|---|
| SMILES | C1=CC2=NO[N+](=C2C=C1C(=O)O)[O-] |
Product Overview
6-Carboxybenzo[c][1,2,5]oxadiazole 1-oxide (CAS 60741-56-2), with molecular formula C7H4N2O4 and molecular weight 180.02 g/mol. IUPAC: 3-oxido-2,1,3-benzoxadiazol-3-ium-5-carboxylic acid.
Chemical Property Profile of 6-Carboxybenzo[c][1,2,5]oxadiazole 1-oxide
Property Insights of 6-Carboxybenzo[c][1,2,5]oxadiazole 1-oxide
The XLogP value of 0.1594 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Carboxybenzo[c][1,2,5]oxadiazole 1-oxide. The TPSA of 90.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Carboxybenzo[c][1,2,5]oxadiazole 1-oxide. Following Lipinski's Rule of Five, 6-Carboxybenzo[c][1,2,5]oxadiazole 1-oxide has 1 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 6-Carboxybenzo[c][1,2,5]oxadiazole 1-oxide?
The CAS number of 6-Carboxybenzo[c][1,2,5]oxadiazole 1-oxide is 60741-56-2.
What is the molecular formula of 6-Carboxybenzo[c][1,2,5]oxadiazole 1-oxide?
The molecular formula of 6-Carboxybenzo[c][1,2,5]oxadiazole 1-oxide is C7H4N2O4.
What is the molecular weight of 6-Carboxybenzo[c][1,2,5]oxadiazole 1-oxide?
The molecular weight of 6-Carboxybenzo[c][1,2,5]oxadiazole 1-oxide is 180.02 g/mol.
Where can I buy 6-Carboxybenzo[c][1,2,5]oxadiazole 1-oxide?
You can request a quote for 6-Carboxybenzo[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 6-Carboxybenzo[c][1,2,5]oxadiazole 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for 6-Carboxybenzo[c][1,2,5]oxadiazole 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.