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1-methylsulfanyl-2-nitro-4-(trifluoromethyl)benzene

1-methylsulfanyl-2-nitro-4-(trifluoromethyl)benzene structure

CAS No:
71236-96-9
Formula:
C8H6F3NO2S
Chemical Name:
1-methylsulfanyl-2-nitro-4-(trifluoromethyl)benzene
Synonyms:
1-methylthio-2-nitro-4-(trifluoromethyl)benzene; Methyl-2-nitro-4-trifluormethylphenylsulfid; 4-Methylthio-3-nitrobenzotrifluoride; 1-(methylsulfanyl)-2-nitro-4-(trifluoromethyl)benzene;

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1-methylsulfanyl-2-nitro-4-(trifluoromethyl)benzene Basic Attributes

Molecular Weight：

237.19900

Exact Mass：

237.00713409

DSSTox ID：

DTXSID10379577

HScode：

2930909090

Characteristics

PSA：

71.12000

XLogP3：

3.85870

Density：

1.44g/cm3

Melting Point：

94ºC

Boiling Point：

256.2ºC

Flash Point：

108.8ºC

Refractive Index：

1.525

Safety Information

hazard class code：

R20/21/22

safety instructions：

S26; S36/37/39

Marks：

Computed Properties

Molecular Weight:237.20
XLogP3:2.7
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:237.00713409
Monoisotopic Mass:237.00713409
Topological Polar Surface Area:71.1
Heavy Atom Count:15
Complexity:241
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-methylsulfanyl-2-nitro-4-(trifluoromethyl)benzene

Basic Attributes
Characteristics
Safety Information
Computed Properties

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