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Home > Encyclopedia > Methyl (1R,2S,3S,5S)-3-(4-iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate

Methyl (1R,2S,3S,5S)-3-(4-iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate

Methyl (1R,2S,3S,5S)-3-(4-iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate structure

Methyl (1R,2S,3S,5S)-3-(4-iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate 

structure
  • CAS No:

    135416-43-2

  • Formula:

    C16H20INO2

  • Chemical Name:

    Methyl (1R,2S,3S,5S)-3-(4-iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate

  • Synonyms:

    8-Azabicyclo[3.2.1]octane-2-carboxylic acid,3-(4-iodophenyl)-8-methyl-,methyl ester,(1R,2S,3S,5S)-;8-Azabicyclo[3.2.1]octane-2-carboxylic acid,3-(4-iodophenyl)-8-methyl-,methyl ester,[1R-(exo,exo)]-;Methyl (1R,2S,3S,5S)-3-(4-iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate;β-CIT;RTI 4229-98;RTI 55;Iometopane;133647-95-7

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

Colourless to yellowish crystals

Methyl (1R,2S,3S,5S)-3-(4-iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate Basic Attributes

385.245

385.24

4H1Z7121WS

Characteristics

29.5

3.3

Drug Information

Compounds that are used in medicine as sources of radiation for radiotherapy and for diagnostic purposes. They have numerous uses in research and industry. (Martindale, The Extra Pharmacopoeia, 30th ed, p1161) (See all compounds classified as Radiopharmaceuticals.)

2-carbomethoxy-3-(4-iodophenyl)tropane

Computed Properties

Molecular Weight:385.24
XLogP3:3.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:385.05388
Monoisotopic Mass:385.05388
Topological Polar Surface Area:29.5
Heavy Atom Count:20
Complexity:368
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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