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1-[bis(benzylsulfonyl)methyl]-4-nitrobenzene

1-[bis(benzylsulfonyl)methyl]-4-nitrobenzene structure

CAS No:
62970-89-2
Formula:
C21H19NO6S2
Chemical Name:
1-[bis(benzylsulfonyl)methyl]-4-nitrobenzene
Synonyms:
MLS003115675;62970-89-2;NSC294739;CHEMBL2137733;DTXSID50315454;ZINC1566676;NSC-294739;SMR001831246

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1-[bis(benzylsulfonyl)methyl]-4-nitrobenzene Basic Attributes

Molecular Weight：

445.5 g/mol

Exact Mass：

445.06537967 g/mol

NSC Number：

294739

DSSTox ID：

DTXSID50315454

Characteristics

PSA：

131 Å²

Computed Properties

Molecular Weight:445.5
XLogP3:3.4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:445.06537967
Monoisotopic Mass:445.06537967
Topological Polar Surface Area:131
Heavy Atom Count:30
Complexity:708
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[bis(benzylsulfonyl)methyl]-4-nitrobenzene

Basic Attributes
Characteristics
Computed Properties

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