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Home > Encyclopedia > 1,1-Dimethylethyl 3-bromo-6-fluoro-1H-indole-1-carboxylate

1,1-Dimethylethyl 3-bromo-6-fluoro-1H-indole-1-carboxylate

1,1-Dimethylethyl 3-bromo-6-fluoro-1H-indole-1-carboxylate structure

1,1-Dimethylethyl 3-bromo-6-fluoro-1H-indole-1-carboxylate 

structure
  • CAS No:

    1314406-46-6

  • Formula:

    C13H13BrFNO2

  • Chemical Name:

    1,1-Dimethylethyl 3-bromo-6-fluoro-1H-indole-1-carboxylate

  • Synonyms:

    1H-Indole-1-carboxylic acid,3-bromo-6-fluoro-,1,1-dimethylethyl ester;1,1-Dimethylethyl 3-bromo-6-fluoro-1H-indole-1-carboxylate;1-Boc-3-bromo-6-fluoroindole

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

1,1-Dimethylethyl 3-bromo-6-fluoro-1H-indole-1-carboxylate Basic Attributes

314.1502232

314.15

2933990090

Characteristics

31.2

4.32610

1.44±0.1 g/cm3(Predicted)

371.2±45.0 °C(Predicted)

Computed Properties

Molecular Weight:314.15
XLogP3:4.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:313.01137
Monoisotopic Mass:313.01137
Topological Polar Surface Area:31.2
Heavy Atom Count:18
Complexity:331
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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