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3-(2-pyridin-2-ylsulfinylethyl)-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine

3-(2-pyridin-2-ylsulfinylethyl)-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine structure

CAS No:
130997-48-7
Formula:
C15H12F3N3O2S2
Chemical Name:
3-(2-pyridin-2-ylsulfinylethyl)-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine

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3-(2-pyridin-2-ylsulfinylethyl)-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine Basic Attributes

Molecular Weight：

387.40000

Exact Mass：

387.03230347

Characteristics

PSA：

115.42000

XLogP3：

4.24910

Density：

1.58g/cm3

Boiling Point：

531.8ºC at 760mmHg

Flash Point：

275.4ºC

Refractive Index：

1.665

Vapor Pressure：

2.17E-11mmHg at 25°C

Computed Properties

Molecular Weight:387.4
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:5
Exact Mass:387.03230347
Monoisotopic Mass:387.03230347
Topological Polar Surface Area:111
Heavy Atom Count:25
Complexity:521
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(2-pyridin-2-ylsulfinylethyl)-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine

Basic Attributes
Characteristics
Computed Properties

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