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Home > Encyclopedia > methyl (1R)-3-(4-azido-3-iodobenzoyl)oxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate

methyl (1R)-3-(4-azido-3-iodobenzoyl)oxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate

methyl (1R)-3-(4-azido-3-iodobenzoyl)oxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate structure

methyl (1R)-3-(4-azido-3-iodobenzoyl)oxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate 

structure
  • CAS No:

    140430-72-4

  • Formula:

    C17H19IN4O4

  • Chemical Name:

    methyl (1R)-3-(4-azido-3-iodobenzoyl)oxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate

  • Synonyms:

    125IACoc;3-iodo-4-azidococaine;IACoc;IACoc;140430-72-4;3-Iodo-4-azidococaine;125IACoc;DTXSID30930821;Methyl 3-[(4-azido-3-iodobenzoyl)oxy]-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate

methyl (1R)-3-(4-azido-3-iodobenzoyl)oxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate Basic Attributes

470.3 g/mol

470.04510 g/mol

Characteristics

70.2 Ų

Drug Information

125IACoc

Computed Properties

Molecular Weight:470.3
XLogP3:3.9
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:470.04510
Monoisotopic Mass:470.04510
Topological Polar Surface Area:70.2
Heavy Atom Count:26
Complexity:612
Defined Atom Stereocenter Count:1
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of methyl (1R)-3-(4-azido-3-iodobenzoyl)oxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate

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