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2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine

2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine structure

CAS No:
175203-50-6
Formula:
C12H11F3N2S
Chemical Name:
2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine
Synonyms:
Ethanamine,2-[[2-(trifluoromethyl)-4-quinolinyl]thio]-;2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine;4-(2-Aminoethylthio)-2-(trifluoromethyl)quinoline;2-[[2-(Trifluoromethyl)-4-quinolyl]thio]ethylamine;2-[2-(Trifluoromethyl)quinolin-4-yl]sulfanylethanamine

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2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine Basic Attributes

Molecular Weight：

272.28900

Exact Mass：

272.29

DSSTox ID：

DTXSID50371015

HScode：

2933499090

Characteristics

PSA：

64.21000

XLogP3：

4.00470

Density：

1.36g/cm3

Melting Point：

97ºC

Boiling Point：

353.3ºC

Flash Point：

167.4ºC

Refractive Index：

1.58

Vapor Pressure：

0.00045mmHg at 25°C

Safety Information

hazard class code：

R36/37/38

safety instructions：

S26

Marks：

Computed Properties

Molecular Weight:272.29
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:272.05950402
Monoisotopic Mass:272.05950402
Topological Polar Surface Area:64.2
Heavy Atom Count:18
Complexity:273
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine

Basic Attributes
Characteristics
Safety Information
Computed Properties

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