1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt
TL;DR: 1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt (CAS 64241-58-3) is a chemical compound with molecular formula C10H8N2O4 and molecular weight 220.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methoxycarbonylphenyl)oxadiazol-3-ium-5-olate
Also Known As: 3-[2-(Methoxycarbonyl)phenyl]sydnone, 3-(2-methoxycarbonylphenyl)oxadiazol-3-ium-5-olate, 1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt, 3-[2-(Methoxycarbonyl)phenyl]-1,2,3-oxadiazol-3-ium-5-olate, 3-[2-Methoxycarbonylphenyl]-1,2,3-oxadiazole -ium-5-olate
| Molecular Formula | C10H8N2O4 |
|---|---|
| Molecular Weight | 220.05 g/mol |
| LogP | -0.1885 |
| Topological Polar Surface Area | 79.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.0484 |
| Heavy Atoms | 16 |
| Complexity | 521.0425 |
Chemical Identifiers
| CAS Number | 64241-58-3 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1[N+]2=NOC(=C2)[O-] |
Product Overview
1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt (CAS 64241-58-3), with molecular formula C10H8N2O4 and molecular weight 220.05 g/mol. IUPAC: 3-(2-methoxycarbonylphenyl)oxadiazol-3-ium-5-olate.
Chemical Property Profile of 1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt
Property Insights of 1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt
The XLogP value of -0.1885 indicates that 1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 79.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt. Following Lipinski's Rule of Five, 1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt 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 1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt?
The CAS number of 1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt is 64241-58-3.
What is the molecular formula of 1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt?
The molecular formula of 1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt is C10H8N2O4.
What is the molecular weight of 1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt?
The molecular weight of 1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt is 220.05 g/mol.
Where can I buy 1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt?
You can request a quote for 1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.