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2-Nitro-1-(phenylthio)-4-(trifluoromethyl)benzene

2-Nitro-1-(phenylthio)-4-(trifluoromethyl)benzene structure

CAS No:
346-44-1
Formula:
C13H8F3NO2S
Chemical Name:
2-Nitro-1-(phenylthio)-4-(trifluoromethyl)benzene
Synonyms:
Benzene,2-nitro-1-(phenylthio)-4-(trifluoromethyl)-;Sulfide,phenyl α,α,α-trifluoro-2-nitro-p-tolyl;2-Nitro-1-(phenylthio)-4-(trifluoromethyl)benzene;(2-Nitro-4-(trifluoromethyl)phenyl)phenylthioether;(2-Nitro-4-(trifluoromethyl)phenyl)(phenyl)sulfane;2-Nitro-1-phenylsulfanyl-4-trifluoromethyl-benzene

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2-Nitro-1-(phenylthio)-4-(trifluoromethyl)benzene Basic Attributes

Molecular Weight：

299.2683296

Exact Mass：

299.27

EC Number：

206-470-5

DSSTox ID：

DTXSID70188167

HScode：

2930909090

Characteristics

PSA：

71.1

XLogP3：

4.2

Density：

1.44g/cm3

Melting Point：

70-71 °C @ Solvent: Ethanol

Boiling Point：

345.8ºC at 760mmHg

Flash Point：

162.9ºC

Refractive Index：

1.593

Computed Properties

Molecular Weight:299.27
XLogP3:4.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:299.02278416
Monoisotopic Mass:299.02278416
Topological Polar Surface Area:71.1
Heavy Atom Count:20
Complexity:340
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Nitro-1-(phenylthio)-4-(trifluoromethyl)benzene

Basic Attributes
Characteristics
Computed Properties

2-Nitro-1-(phenylthio)-4-(trifluoromethyl)benzene

SDS

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