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methyl (1R,2S,3S,5S)-3-(4-fluorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate(CAS: 50370-56-4)

methyl (1R,2S,3S,5S)-3-(4-fluorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate
CAS Number

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Basic Information

Molecular Formula
C16H20FNO2
Molecular Weight
277.33 g/mol

Physical Properties

Melting Point
91-92 ºC
Boiling Point
349 ºC
Flash Point
165 ºC

Chemical Identifiers

SMILES
CN1C2CCC1C(C(C2)C3=CC=C(C=C3)F)C(=O)OC
InChIKey
QUSLQENMLDRCTO-YJNKXOJESA-N

Database References

FAQ

Methyl (1R,2S,3S,5S)-3-(4-fluorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate has a crystalline form with a molecular weight of approximately 304.21 g/mol. It is slightly soluble in water but soluble in organic solvents. This compound is reactive towards nucleophiles and acidic conditions. It has a pKa of approximately 2.5.
Methyl (1R,2S,3S,5S)-3-(4-fluorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate is typically synthesized through a multistep process involving condensation reactions, cyclization, and esterification. The synthesis can involve the use of catalysts such as p-toluenesulfonic acid and can yield up to 90% purity with good selectivity.
Methyl (1R,2S,3S,5S)-3-(4-fluorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate is mainly used in the pharmaceutical industry for the development of certain drugs and in the chemical industry for its use as a precursor in organic synthesis. It can also find applications in polymer chemistry and as a reagent in analytical chemistry.
When handling methyl (1R,2S,3S,5S)-3-(4-fluorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate, appropriate personal protective equipment (PPE) should be worn, including gloves, goggles, and a laboratory coat. It should be stored in a cool, dry place, away from direct sunlight and heat sources. Spills should be handled with care, and the Material Safety Data Sheet (MSDS) should be consulted for specific emergency procedures.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

Contact Information

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