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399-75-7

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399-75-7 Structure

399-75-7 Structure
IdentificationMore
[Name]

5-FLUORO-2-METHYLBENZOTHIAZOLE
[CAS]

399-75-7
[Synonyms]

2-METHYL-5-FLUOROBENZOTHIAZOLE
5-FLUORO-2-METHYLBENZOTHIAZOLE
Benzothiazole, 5-fluoro-2-methyl-(7CI,8CI,9CI)
5-Fluoro-2-methylbenzothiazole 97%
5-Fluoro-2-methylbenzothiazole97%
5-FLUORO-2-METHYLBENZOTHIAZOLE 95+% GC
[Molecular Formula]

C8H6FNS
[MDL Number]

MFCD00135018
[Molecular Weight]

167.2
[MOL File]

399-75-7.mol
Chemical PropertiesBack Directory
[Boiling point ]

110-112 °C7 mm Hg(lit.)
[density ]

1.256 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.584(lit.)
[Fp ]

185 °F
[storage temp. ]

Refrigerator, under inert atmosphere
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Oil
[pka]

1.51±0.10(Predicted)
[color ]

Colourless to Pale Yellow
[Specific Gravity]

1.256
[InChI]

InChI=1S/C8H6FNS/c1-5-10-7-4-6(9)2-3-8(7)11-5/h2-4H,1H3
[InChIKey]

LDBFGRGBYVULTJ-UHFFFAOYSA-N
[SMILES]

S1C2=CC=C(F)C=C2N=C1C
[CAS DataBase Reference]

399-75-7(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H227
[Precautionary statements ]

P210-P280-P403+P235-P501
[Hazard Codes ]

Xi
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HS Code ]

2934208090
[Storage Class]

10 - Combustible liquids
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Benzene-->Pyridine-->Sodium hydride-->Iron-->Phosphorus pentasulfide-->1,4-Difluorobenzene
Hazard InformationBack Directory
[Uses]

5-Fluoro-2-methylbenzothiazole is a useful reactant in the preparation of antileishmanial drug candidates.
Spectrum DetailBack Directory
[Spectrum Detail]

5-FLUORO-2-METHYLBENZOTHIAZOLE(399-75-7)MS
5-FLUORO-2-METHYLBENZOTHIAZOLE(399-75-7)1HNMR
5-FLUORO-2-METHYLBENZOTHIAZOLE(399-75-7)13CNMR
5-FLUORO-2-METHYLBENZOTHIAZOLE(399-75-7)IR1
5-FLUORO-2-METHYLBENZOTHIAZOLE(399-75-7)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

399-75-7(sigmaaldrich)
[TCI AMERICA]

5-Fluoro-2-methylbenzothiazole,>95.0%(GC)(399-75-7)
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