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1-[2-[4-(TRIFLUOROMETHOXY)PHENYL]-1,3-THIAZOL-4-YL]ETHAN-1-ONE

1-[2-[4-(TRIFLUOROMETHOXY)PHENYL]-1,3-THIAZOL-4-YL]ETHAN-1-ONE structure

CAS No:
265126-59-8
Formula:
C12H8F3NO2S
Chemical Name:
1-[2-[4-(TRIFLUOROMETHOXY)PHENYL]-1,3-THIAZOL-4-YL]ETHAN-1-ONE
Synonyms:
1-[2-(4-Trifluoromethoxy-phenyl)-thiazol-4-yl]-ethanone;1-[2-[4-(TRIFLUOROMETHOXY)PHENYL]-1,3-THIAZOL-4-YL]ETHAN-1-ONE;Ethanone, 1-[2-[4-(trifluoromethoxy)phenyl]-4-thiazolyl]-

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1-[2-[4-(TRIFLUOROMETHOXY)PHENYL]-1,3-THIAZOL-4-YL]ETHAN-1-ONE Basic Attributes

Molecular Weight：

287.26

Exact Mass：

287.02278416

DSSTox ID：

DTXSID30372545

Characteristics

PSA：

67.43000

XLogP3：

3.91130

Density：

1.372±0.06 g/cm3

Melting Point：

45.5 °C

Boiling Point：

349.3±52.0 °C(Predicted)

Flash Point：

165ºC

Refractive Index：

1.528

Vapor Pressure：

4.76E-05mmHg at 25°C

PKA：

-0.72±0.10

Computed Properties

Molecular Weight:287.26
XLogP3:3.8
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:287.02278416
Monoisotopic Mass:287.02278416
Topological Polar Surface Area:67.4
Heavy Atom Count:19
Complexity:329
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[2-[4-(TRIFLUOROMETHOXY)PHENYL]-1,3-THIAZOL-4-YL]ETHAN-1-ONE

Basic Attributes
Characteristics
Computed Properties

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