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169037-23-4

169037-23-4 Structure

169037-23-4 Structure
IdentificationMore
[Name]

5-(TRIFLUOROMETHOXY)ISATIN
[CAS]

169037-23-4
[Synonyms]

5-(TRIFLUOROMETHOXY)ISATIN
5-(TRIFLUOROMETHOXYL)INDOLINE-2,3-DIONE
BUTTPARK 34\07-90
5-(Trifluoromethoxy)indoline-2,3-dione
5-(TRIFLUOROMETHOXY)-1H-INDOLE-2,3-DIONE
5-(Trifluoromethoxy)indoline-2,3-dione 97%
5-(Trifluoromethoxy)indoline-2,3-dione97%
[EINECS(EC#)]

1592732-453-0
[Molecular Formula]

C9H4F3NO3
[MDL Number]

MFCD00192524
[Molecular Weight]

231.13
[MOL File]

169037-23-4.mol
Chemical PropertiesBack Directory
[Melting point ]

170-172 °C(lit.)
[density ]

1.562±0.06 g/cm3(Predicted)
[storage temp. ]

Keep Cold
[form ]

powder to crystal
[pka]

8.49±0.20(Predicted)
[color ]

Light yellow to Brown
[Water Solubility ]

Insoluble in water.
[InChI]

1S/C9H4F3NO3/c10-9(11,12)16-4-1-2-6-5(3-4)7(14)8(15)13-6/h1-3H,(H,13,14,15)
[InChIKey]

XHAJMVPMNOBILF-UHFFFAOYSA-N
[SMILES]

FC(F)(F)Oc1ccc2NC(=O)C(=O)c2c1
[CAS DataBase Reference]

169037-23-4(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264b-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P362+P364-P403+P233-P501c
[Hazard Codes ]

Xi
[Safety Statements ]

24/25
[WGK Germany ]

3
[Hazard Note ]

Irritant/Keep Cold
[HS Code ]

29339900
[Storage Class]

13 - Non Combustible Solids
Hazard InformationBack Directory
[Uses]

5-(Trifluoromethoxy)isatin is used as a reactant for preparation of oxindole derivatives as TAk1 kinase inhibitors and of isatin thiosemicarbazones via condensation with thiosemicarbazones as herpes simplex virus (HSV) inhibitors. It is also used as a reactant for synthesis of 3-substituted 2-indolinone RET kinase inhibitors and for preparation of indolone acetamides as antiseizure agents.
Spectrum DetailBack Directory
[Spectrum Detail]

5-(TRIFLUOROMETHOXY)ISATIN(169037-23-4)1HNMR
5-(TRIFLUOROMETHOXY)ISATIN(169037-23-4)FT-IR
5-(TRIFLUOROMETHOXY)ISATIN(169037-23-4)IR
5-(TRIFLUOROMETHOXY)ISATIN(169037-23-4)Raman
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

5-(Trifluoromethoxy)isatin, 98%(169037-23-4)
[Sigma Aldrich]

169037-23-4(sigmaaldrich)
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