3-(1,3-benzodioxol-5-ylmethyl)-2H-oxadiazol-3-ium-5-one
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3-(1,3-benzodioxol-5-ylmethyl)-2H-oxadiazol-3-ium-5-one
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CAS No:
7356-65-2
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Formula:
C10H9N2O4+
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Chemical Name:
3-(1,3-benzodioxol-5-ylmethyl)-2H-oxadiazol-3-ium-5-one
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Synonyms:
7356-65-2;NSC74441;DTXSID30328966;NSC-74441;3-[(2H-1,3-Benzodioxol-5-yl)methyl]-5-oxo-2,5-dihydro-1,2,3-oxadiazol-3-ium
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CAS No:
3-(1,3-benzodioxol-5-ylmethyl)-2H-oxadiazol-3-ium-5-one Basic Attributes
221.19 g/mol
221.05623177 g/mol
74441
DTXSID30328966
Computed Properties
Molecular Weight:221.19
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:221.05623177
Monoisotopic Mass:221.05623177
Topological Polar Surface Area:59.8
Heavy Atom Count:16
Formal Charge:1
Complexity:331
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 3-(1,3-benzodioxol-5-ylmethyl)-2H-oxadiazol-3-ium-5-one
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