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1-(Methylsulfonyl)-3-nitrobenzene

1-(Methylsulfonyl)-3-nitrobenzene structure

CAS No:
2976-32-1
Formula:
C7H7NO4S
Chemical Name:
1-(Methylsulfonyl)-3-nitrobenzene
Synonyms:
Benzene,1-(methylsulfonyl)-3-nitro-;Sulfone,methyl m-nitrophenyl;1-(Methylsulfonyl)-3-nitrobenzene;Methyl m-nitrophenyl sulfone;Methyl 3-nitrophenyl sulfone;1-Methanesulfonyl-3-nitrobenzene

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1-(Methylsulfonyl)-3-nitrobenzene Basic Attributes

Molecular Weight：

201.20000

Exact Mass：

201.20

DSSTox ID：

DTXSID60183909

HScode：

2904909090

Characteristics

PSA：

88.34000

XLogP3：

2.60230

Density：

1.406g/cm3

Melting Point：

146 °C

Boiling Point：

392.8ºC at 760mmHg

Flash Point：

191.3ºC

Refractive Index：

1.559

Computed Properties

Molecular Weight:201.20
XLogP3:0.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:201.00957888
Monoisotopic Mass:201.00957888
Topological Polar Surface Area:88.3
Heavy Atom Count:13
Complexity:287
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(Methylsulfonyl)-3-nitrobenzene

Basic Attributes
Characteristics
Computed Properties

1-(Methylsulfonyl)-3-nitrobenzene

SDS

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