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1-isothiocyanato-4-(4-nitrophenyl)sulfonylbenzene

1-isothiocyanato-4-(4-nitrophenyl)sulfonylbenzene structure

CAS No:
15398-73-9
Formula:
C13H8N2O4S2
Chemical Name:
1-isothiocyanato-4-(4-nitrophenyl)sulfonylbenzene
Synonyms:
15398-73-9;NSC291541;1-isothiocyanato-4-(4-nitrophenyl)sulfonylbenzene;DTXSID00315040;NSC-291541

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1-isothiocyanato-4-(4-nitrophenyl)sulfonylbenzene Basic Attributes

Molecular Weight：

320.3 g/mol

Exact Mass：

319.99254909 g/mol

NSC Number：

291541

DSSTox ID：

DTXSID00315040

Characteristics

PSA：

133 Å²

Computed Properties

Molecular Weight:320.3
XLogP3:4.1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:319.99254909
Monoisotopic Mass:319.99254909
Topological Polar Surface Area:133
Heavy Atom Count:21
Complexity:515
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-isothiocyanato-4-(4-nitrophenyl)sulfonylbenzene

Basic Attributes
Characteristics
Computed Properties

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