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1-(benzenesulfinylmethyl)-4-nitrobenzene

1-(benzenesulfinylmethyl)-4-nitrobenzene structure

CAS No:
17530-84-6
Formula:
C13H11NO3S
Chemical Name:
1-(benzenesulfinylmethyl)-4-nitrobenzene
Synonyms:
4-nitrobenzyl phenyl sulfoxide;MLS002707254;17530-84-6;NSC122658;4-Nitrobenzylphenyl sulfoxide;CHEMBL1897206;DTXSID30298352;NSC-122658;SMR001574648

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1-(benzenesulfinylmethyl)-4-nitrobenzene Basic Attributes

Molecular Weight：

261.30 g/mol

Exact Mass：

261.04596439 g/mol

NSC Number：

122658

DSSTox ID：

DTXSID30298352

Characteristics

PSA：

82.1 Å²

Computed Properties

Molecular Weight:261.30
XLogP3:2.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:261.04596439
Monoisotopic Mass:261.04596439
Topological Polar Surface Area:82.1
Heavy Atom Count:18
Complexity:302
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(benzenesulfinylmethyl)-4-nitrobenzene

Basic Attributes
Characteristics
Computed Properties

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