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587886-26-8

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587886-26-8 Structure

587886-26-8 Structure
IdentificationBack Directory
[Name]

2-(TRIFLUOROMETHYL)QUINOLINE-3-CARBOXYLIC ACID
[CAS]

587886-26-8
[Synonyms]

2-(TRIFLUOROMETHYL)QUINOLINE-3-CARBOXYLIC ACID
3-Quinolinecarboxylic acid, 2-(trifluoroMethyl)-
[EINECS(EC#)]

604-604-1
[Molecular Formula]

C11H6F3NO2
[MDL Number]

MFCD01862086
[MOL File]

587886-26-8.mol
[Molecular Weight]

241.17
Chemical PropertiesBack Directory
[Melting point ]

207-209 °C(Solv: methanol (67-56-1))
[Boiling point ]

321.2±42.0 °C(Predicted)
[density ]

1.481±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,2-8°C
[pka]

2.42±0.30(Predicted)
[Appearance]

Light yellow to light brown Solid
[InChI]

InChI=1S/C11H6F3NO2/c12-11(13,14)9-7(10(16)17)5-6-3-1-2-4-8(6)15-9/h1-5H,(H,16,17)
[InChIKey]

VIUDHZOBRHLGGI-UHFFFAOYSA-N
[SMILES]

N1C2C(=CC=CC=2)C=C(C(O)=O)C=1C(F)(F)F
Safety DataBack Directory
[Hazard Codes ]

Xi
[Hazard Note ]

Irritant
[HS Code ]

2933499090
Spectrum DetailBack Directory
[Spectrum Detail]

2-(TRIFLUOROMETHYL)QUINOLINE-3-CARBOXYLIC ACID(587886-26-8)1HNMR
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