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4,4-dimethoxy-1-oxido-6,7-dihydro-5H-2,1,3-benzoxadiazol-1-ium-5-ol

4,4-dimethoxy-1-oxido-6,7-dihydro-5H-2,1,3-benzoxadiazol-1-ium-5-ol structure

CAS No:
330982-47-3
Formula:
C8H12N2O5
Chemical Name:
4,4-dimethoxy-1-oxido-6,7-dihydro-5H-2,1,3-benzoxadiazol-1-ium-5-ol
Synonyms:
NSC663961;Oprea1_153037;CHEMBL1981465;4,4-Dimethoxy-4,5,6,7-tetrahydro-2,1,3-benzoxadiazol-5-ol 1-oxide;STK834836;4,4-dimethoxy-1-oxido-6,7-dihydro-5H-2,1,3-benzoxadiazol-1-ium-5-ol;AKOS005623968;NSC-663961;NCI60_021983;4,4-Dimethoxy-4,5,6,7-tetrahydro-2,1.lambda.~5~,3-benzoxadiazole-1,5-diol;330982-47-3

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4,4-dimethoxy-1-oxido-6,7-dihydro-5H-2,1,3-benzoxadiazol-1-ium-5-ol Basic Attributes

Molecular Weight：

216.19 g/mol

Exact Mass：

216.07462149 g/mol

NSC Number：

663961

Characteristics

PSA：

90.2 Å²

Computed Properties

Molecular Weight:216.19
XLogP3:-0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:216.07462149
Monoisotopic Mass:216.07462149
Topological Polar Surface Area:90.2
Heavy Atom Count:15
Complexity:235
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4,4-dimethoxy-1-oxido-6,7-dihydro-5H-2,1,3-benzoxadiazol-1-ium-5-ol

Basic Attributes
Characteristics
Computed Properties

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