3-[4-(5-oxo-2H-oxadiazol-3-ium-3-yl)butyl]-2H-oxadiazol-3-ium-5-one
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![3-[4-(5-oxo-2H-oxadiazol-3-ium-3-yl)butyl]-2H-oxadiazol-3-ium-5-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/7b0c088a9bf64272a6295a0fb8d2a190.png "3-[4-(5-oxo-2H-oxadiazol-3-ium-3-yl)butyl]-2H-oxadiazol-3-ium-5-one")
3-[4-(5-oxo-2H-oxadiazol-3-ium-3-yl)butyl]-2H-oxadiazol-3-ium-5-one
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CAS No:
6951-22-0
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Formula:
C8H12N4O4+2
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Chemical Name:
3-[4-(5-oxo-2H-oxadiazol-3-ium-3-yl)butyl]-2H-oxadiazol-3-ium-5-one
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Synonyms:
Sydnone, 3,3'-tetramethylenedi-;NSC-54672;NCI60_004346;6951-22-0;NCIStruc1_000348;NCIStruc2_000469;CHEMBL1516415;NCI54672;ZINC6523959;CCG-38254;NCGC00013673;NCGC00013673-02;NCGC00096785-01
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CAS No:
3-[4-(5-oxo-2H-oxadiazol-3-ium-3-yl)butyl]-2H-oxadiazol-3-ium-5-one Basic Attributes
228.21 g/mol
228.08585488 g/mol
Computed Properties
Molecular Weight:228.21
XLogP3:0.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:228.08585488
Monoisotopic Mass:228.08585488
Topological Polar Surface Area:82.7
Heavy Atom Count:16
Formal Charge:2
Complexity:340
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 3-[4-(5-oxo-2H-oxadiazol-3-ium-3-yl)butyl]-2H-oxadiazol-3-ium-5-one
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