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62606-00-2

62606-00-2 Structure

62606-00-2 Structure
IdentificationBack Directory
[Name]

3-broMo-5-Methanesulfonylaniline
[CAS]

62606-00-2
[Synonyms]

3-broMo-5-Methanesulfonylaniline
3-BroMo-5-(Methylsulfonyl)aniline
3-Bromo-5-(methylsulfonyl)benzenamine
3-Bromo-5-(methylsulphonyl)aniline 98%
Benzenamine, 3-bromo-5-(methylsulfonyl)-
[Molecular Formula]

C7H8BrNO2S
[MDL Number]

MFCD17392822
[MOL File]

62606-00-2.mol
[Molecular Weight]

250.11
Chemical PropertiesBack Directory
[Boiling point ]

452.9±45.0 °C(Predicted)
[density ]

1.671±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Inert atmosphere,Room temperature
[pka]

1.58±0.10(Predicted)
[Appearance]

White to yellow Solid
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P280-P301+P312-P362+P364
[HS Code ]

2921420090
Hazard InformationBack Directory
[Uses]

3-Bromo-5-(methylsulfonyl)aniline is used in the preparation of WDR5-?MYC inhibitors.
[Synthesis]

1-broMo-3-Methanesulfonyl-5-nitrobenzene

62606-15-9

3-broMo-5-Methanesulfonylaniline

62606-00-2

General procedure for the synthesis of 3-bromo-5-(methylsulfonyl)aniline from 1-bromo-3-(methylsulfonyl)-5-nitrobenzene: 1-bromo-3-(methylsulfonyl)-5-nitrobenzene (100 mg, 0.4 mmol) was dissolved in tetrahydrofuran (THF, 10 mL). Raney nickel catalyst was added and the hydrogenation reaction was carried out under 1 bar hydrogen pressure. Upon completion of the reaction, the mixture was filtered to remove the catalyst and the filtrate was subsequently concentrated. 3-Bromo-5-(methylsulfonyl)aniline (30 mg, 0.16 mmol, 40% yield) was finally obtained as a yellow solid.

[References]

[1] Patent: EP1953163, 2008, A1. Location in patent: Page/Page column 13
[2] Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), 1977, p. 14 - 17
Spectrum DetailBack Directory
[Spectrum Detail]

3-broMo-5-Methanesulfonylaniline(62606-00-2)1HNMR
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