AKOS B018372
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AKOS B018372
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CAS No:
153568-04-8
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Formula:
C11H6F3NOS2
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Chemical Name:
AKOS B018372
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Synonyms:
AKOS B018372;CHEMBRDG-BB 3018372;ART-CHEM-BB B018372;(5E)-2-mercapto-5-[2-(trifluoromethyl)benzylidene]-1,3-thiazol-4(5H)-one;Albb-009182;(5E)-2-mercapto-5-[2-(trifluoromethyl)benzylidene]-1,3-thiazol-4(5H)-one(SALTDATA: FREE);(5E)-2-;(5E)-2-sulfanylidene-5-[[2-(trifluoromethyl)phenyl]methylidene]-1,3-thiazolidin-4-one
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CAS No:
Characteristics
86.5
3.7
1.55±0.1 g/cm3(Predicted)
355.4ºC at 760 mmHg
168.7ºC
1.637
3.14E-05mmHg at 25°C
Computed Properties
Molecular Weight:289.3
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:288.98429065
Monoisotopic Mass:288.98429065
Topological Polar Surface Area:86.5
Heavy Atom Count:18
Complexity:406
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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