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2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione structure
Fine Chemical

2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione

TL;DR: 2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione (CAS 1217981-95-7) is a chemical compound with molecular formula C10H10N2O5 and molecular weight 238.05898 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione

Also Known As: ZERO/003033, 2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione, 1-(4-oxo-6,8-dioxabicyclo[3.2.1]oct-2-yl)-1,2-dihydropyridazine-3,6-dione, 1-[(2S,5R)-4-oxo-6,8-dioxabicyclo[3.2.1]oct-2-yl]-1,2-dihydropyridazine-3,6-dione, 1-{4-OXO-6,8-DIOXABICYCLO[3.2.1]OCTAN-2-YL}-1,2,3,6-TETRAHYDROPYRIDAZINE-3,6-DIONE

CAS Number
1217981-95-7
Molecular Formula
C10H10N2O5
Molecular Weight
238.05898 g/mol
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Technical Specifications

Molecular FormulaC10H10N2O5
Molecular Weight238.05898 g/mol
XLogP-1.5
Topological Polar Surface Area (TPSA)84.9 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors5
Rotatable Bonds1
Exact Mass238.05898 Da
Heavy Atoms17
Complexity432.0
SMILESC1C(C2COC(C1=O)O2)N3C(=O)C=CC(=O)N3
InChIKeyDGSIMEVNVKAFAF-UHFFFAOYSA-N

Chemical Property Profile of 2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione

XLogP
-1.5
TPSA (Topological Polar Surface Area)
84.9
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
1
Heavy Atoms
17
Complexity
432.0
Exact Mass
238.05898
Monoisotopic Mass
238.05898
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 2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione

The XLogP value of -1.5 indicates that 2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 84.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione. Following Lipinski's Rule of Five, 2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione has 1 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 CAS number of 2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione?

The CAS number of 2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione is 1217981-95-7.

What is the molecular formula of 2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione?

The molecular formula of 2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione is C10H10N2O5.

What is the molecular weight of 2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione?

The molecular weight of 2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione is 238.05898 g/mol.

Where can I buy 2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione?

You can request a quote for 2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione?

Yes, CoreyChem provides custom synthesis services for 2-(4-oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-1H-pyridazine-3,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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