5-(2-oxo-3H-1,3,4-oxadiazol-5-yl)-3H-1,3,4-oxadiazol-2-one

Base Information

• Chemical Name: 5-(2-oxo-3H-1,3,4-oxadiazol-5-yl)-3H-1,3,4-oxadiazol-2-one
• CAS No.: 54685-47-1
• Molecular Formula: C4H2N4O4
• NSC Number: 119338
• DSSTox Substance ID: DTXSID90297927
• Wikidata: Q82039439
• ChEMBL ID: CHEMBL1716619

Synonyms:MLS002706860;54685-47-1;NSC119338;CHEMBL1716619;DTXSID90297927;NSC-119338;SMR001574257

Chemical Property of 5-(2-oxo-3H-1,3,4-oxadiazol-5-yl)-3H-1,3,4-oxadiazol-2-one

Chemical Property:

• XLogP3: -0.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 170.00760456
• Heavy Atom Count: 12
• Complexity: 287

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1(=NNC(=O)O1)C2=NNC(=O)O2

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