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3,6-dioxido-7-phenyl-4,5-dihydrotriazolo[4,5-e][2,1,3]benzoxadiazole-3,6-diium

3,6-dioxido-7-phenyl-4,5-dihydrotriazolo[4,5-e][2,1,3]benzoxadiazole-3,6-diium structure

CAS No:
5256-29-1
Formula:
C12H9N5O3
Chemical Name:
3,6-dioxido-7-phenyl-4,5-dihydrotriazolo[4,5-e][2,1,3]benzoxadiazole-3,6-diium
Synonyms:
3,6-dioxido-7-phenyl-4,5-dihydrotriazolo[4,5-e][2,1,3]benzoxadiazole-3,6-diium;5256-29-1;Cambridge id 5256291;CHEMBL3183236;DTXSID60366831;ZINC2810853;SDCCGMLS-0064768.P001;NCGC00240917-01;AB00076886-01;BRD-K55066264-001-01-9

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3,6-dioxido-7-phenyl-4,5-dihydrotriazolo[4,5-e][2,1,3]benzoxadiazole-3,6-diium Basic Attributes

Molecular Weight：

271.23 g/mol

Exact Mass：

271.07053917 g/mol

DSSTox ID：

DTXSID60366831

Characteristics

PSA：

94.8 Å²

Computed Properties

Molecular Weight:271.23
XLogP3:2.3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:271.07053917
Monoisotopic Mass:271.07053917
Topological Polar Surface Area:94.8
Heavy Atom Count:20
Complexity:367
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,6-dioxido-7-phenyl-4,5-dihydrotriazolo[4,5-e][2,1,3]benzoxadiazole-3,6-diium

Basic Attributes
Characteristics
Computed Properties

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