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

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

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

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

structure
  • CAS No:

    50372-80-0

  • Formula:

    C16H21NO2

  • Chemical Name:

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

  • Synonyms:

    8-Azabicyclo[3.2.1]octane-2-carboxylic acid,8-methyl-3-phenyl-,methyl ester,(1R,2S,3S,5S)-;8-Azabicyclo[3.2.1]octane-2-carboxylic acid,8-methyl-3-phenyl-,methyl ester,[1R-(exo,exo)]-;Methyl (1R,2S,3S,5S)-8-methyl-3-phenyl-8-azabicyclo[3.2.1]octane-2-carboxylate;Win 35065-2;Win 33065-2

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

Colourless crystals

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

409.43

259.34

AH3LC885W8

Characteristics

29.5

2.6

white

1.099±0.06 g/cm3(Predicted)

H2O: soluble

−20°C

Safety Information

3

CL5603110

Drug Information

(1R-(exo,exo))-8-methyl-3-phenyl-8-azabicyclo(3.2.1)octane-2-carboxylic acid methyl ester

Methyl (1R,2S,3S,5S)-8-methyl-3-phenyl-8-azabicyclo[3.2.1]octane-2-carboxylate Use and Manufacturing

[1R-(exo,exo)]- 8-Methyl-3-phenyl-8-azabicyclo[3.2.1]octane-2-carboxylic Acid Methyl Ester is an intermediate in the synthesis of RTI-55 (R701010), a semi-synthetic alkaloid that is a cocaine analogue belonging to the phenyltropane group.

Computed Properties

Molecular Weight:259.34
XLogP3:2.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:259.157228913
Monoisotopic Mass:259.157228913
Topological Polar Surface Area:29.5
Heavy Atom Count:19
Complexity:338
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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