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4-benzylsulfanyl-7-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium

4-benzylsulfanyl-7-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium structure

CAS No:
53619-46-8
Formula:
C13H9N3O4S
Chemical Name:
4-benzylsulfanyl-7-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium
Synonyms:
53619-46-8;NSC228115;DTXSID90310544;NSC-228115;7-(Benzylsulfanyl)-4-nitro-1-oxo-2,1lambda~5~,3-benzoxadiazole

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4-benzylsulfanyl-7-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium Basic Attributes

Molecular Weight：

303.30 g/mol

Exact Mass：

303.03137695 g/mol

NSC Number：

228115

DSSTox ID：

DTXSID90310544

Characteristics

PSA：

123 Å²

Computed Properties

Molecular Weight:303.30
XLogP3:3.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:303.03137695
Monoisotopic Mass:303.03137695
Topological Polar Surface Area:123
Heavy Atom Count:21
Complexity:375
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-benzylsulfanyl-7-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium

Basic Attributes
Characteristics
Computed Properties

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