1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt structure

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

CAS: 64241-58-3
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.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of 1,2,3-Oxadiazolium, 5-hydroxy-3-[2-(methoxycarbonyl)phenyl]-, inner salt

XLogP
-0.1885
TPSA (Topological Polar Surface Area)
79.27
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
Rotatable Bonds
2
Heavy Atoms
16
Complexity
521.0425
Exact Mass
220.0484
Monoisotopic Mass
220.0484
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

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

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

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.

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