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1-[(1-Methylethyl)sulfonyl]-2-nitrobenzene

1-[(1-Methylethyl)sulfonyl]-2-nitrobenzene structure

CAS No:
70415-86-0
Formula:
C9H11NO4S
Chemical Name:
1-[(1-Methylethyl)sulfonyl]-2-nitrobenzene
Synonyms:
Benzene,1-[(1-methylethyl)sulfonyl]-2-nitro-;1-[(1-Methylethyl)sulfonyl]-2-nitrobenzene;Isopropyl 2-nitrophenyl sulfone;1-(Isopropylsulfonyl)-2-nitrobenzene

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1-[(1-Methylethyl)sulfonyl]-2-nitrobenzene Basic Attributes

Molecular Weight：

229.253

Exact Mass：

229.25

DSSTox ID：

DTXSID40500690

HScode：

2904909090

Characteristics

PSA：

88.34000

XLogP3：

1.29

Density：

1.3±0.1 g/cm3

Melting Point：

59.5 °C

Boiling Point：

405.4±37.0 °C at 760 mmHg

Flash Point：

199.0±26.5 °C

Refractive Index：

1.541

Computed Properties

Molecular Weight:229.26
XLogP3:1.8
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:229.04087901
Monoisotopic Mass:229.04087901
Topological Polar Surface Area:88.3
Heavy Atom Count:15
Complexity:325
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[(1-Methylethyl)sulfonyl]-2-nitrobenzene

Basic Attributes
Characteristics
Computed Properties

1-[(1-Methylethyl)sulfonyl]-2-nitrobenzene

SDS

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