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1-Fluoro-5-methyl-4-(methylsulfonyl)-2-nitrobenzene

1-Fluoro-5-methyl-4-(methylsulfonyl)-2-nitrobenzene structure

CAS No:
849035-74-1
Formula:
C8H8FNO4S
Chemical Name:
1-Fluoro-5-methyl-4-(methylsulfonyl)-2-nitrobenzene
Synonyms:
Benzene,1-fluoro-5-methyl-4-(methylsulfonyl)-2-nitro-;1-Fluoro-5-methyl-4-(methylsulfonyl)-2-nitrobenzene

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1-Fluoro-5-methyl-4-(methylsulfonyl)-2-nitrobenzene Basic Attributes

Molecular Weight：

233.21700

Exact Mass：

233.22

DSSTox ID：

DTXSID90382261

HScode：

2904909090

Characteristics

PSA：

88.34000

XLogP3：

3.04980

Melting Point：

150-151ºC

Safety Information

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:233.22
XLogP3:1.5
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:233.01580707
Monoisotopic Mass:233.01580707
Topological Polar Surface Area:88.3
Heavy Atom Count:15
Complexity:345
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-Fluoro-5-methyl-4-(methylsulfonyl)-2-nitrobenzene

Basic Attributes
Characteristics
Safety Information
Computed Properties

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