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3-[2-(pyridin-2-ylmethylsulfanyl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine

3-[2-(pyridin-2-ylmethylsulfanyl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine structure

CAS No:
130997-47-6
Formula:
C16H14F3N3OS2
Chemical Name:
3-[2-(pyridin-2-ylmethylsulfanyl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine

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3-[2-(pyridin-2-ylmethylsulfanyl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine Basic Attributes

Molecular Weight：

385.42700

Exact Mass：

385.05303891

Characteristics

PSA：

104.44000

XLogP3：

4.50900

Density：

1.44g/cm3

Boiling Point：

468.4ºC at 760mmHg

Flash Point：

237.1ºC

Refractive Index：

1.629

Vapor Pressure：

5.98E-09mmHg at 25°C

Computed Properties

Molecular Weight:385.4
XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:385.05303891
Monoisotopic Mass:385.05303891
Topological Polar Surface Area:99.8
Heavy Atom Count:25
Complexity:466
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-[2-(pyridin-2-ylmethylsulfanyl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine

Basic Attributes
Characteristics
Computed Properties

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