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Home > Encyclopedia > 3-broMo-5-Methanesulfonylaniline

3-broMo-5-Methanesulfonylaniline

3-broMo-5-Methanesulfonylaniline structure

3-broMo-5-Methanesulfonylaniline 

structure
  • CAS No:

    62606-00-2

  • Formula:

    C7H8BrNO2S

  • Chemical Name:

    3-broMo-5-Methanesulfonylaniline

  • Synonyms:

    3-Bromo-5-(methylsulfonyl)aniline;3-BROMO-5-METHANESULFONYLANILINE;SCHEMBL2874989;3-bromo-5-methylsulfonylaniline;CTK2B6274;DTXSID80738314;3-Bromo-5-(methanesulfonyl)aniline;KS-00000QJ3;3-Bromo-5-(methylsulfonyl)-aniline;ANW-67966

3-broMo-5-Methanesulfonylaniline Basic Attributes

250.11292

248.94600

DTXSID80738314

2921420090

Characteristics

68.5

1.2

1.671±0.06 g/cm3(Predicted)

3-broMo-5-Methanesulfonylaniline Use and Manufacturing

1-Bromo-3-methylsulfonyl-5-nitro-benzene (100 mg; 0.4 mmol) was dissolved in THF (10 ml). Raney-Nickelwas added and the mixture hydrogenated at 1 bar. The reaction mixture was filtrated and concentrated. 30 mg (0.16mmol; 40percent) of target compound were obtained as a yellow solid.1-Bromo-3-methylsulfonyl-5-nitro-benzene (100 mg; 0.4 mmol) was dissolved in THF (10 ml). Raney-Nickelwas added and the mixture hydrogenated at 1 bar. The reaction mixture was filtrated and concentrated. 30 mg (0.16mmol; 40%) of target compound were obtained as a yellow solid.

Computed Properties

Molecular Weight:250.12
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:248.94591
Monoisotopic Mass:248.94591
Topological Polar Surface Area:68.5
Heavy Atom Count:12
Complexity:247
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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