1-Benzylazetidin-3-ol Chemical Properties

Melting point:

64-65 °C

Boiling point:

259.2±33.0 °C(Predicted)

Density 

1.188±0.06 g/cm3(Predicted)

storage temp. 

Inert atmosphere,Room Temperature

pka

14.33±0.20(Predicted)

form 

crystals

color 

White

Sensitive 

Air Sensitive

InChI

InChI=1S/C10H13NO/c12-10-7-11(8-10)6-9-4-2-1-3-5-9/h1-5,10,12H,6-8H2

InChIKey

JOXQHYFVXZZGQZ-UHFFFAOYSA-N

SMILES

N1(CC2=CC=CC=C2)CC(O)C1

CAS DataBase Reference

54881-13-9(CAS DataBase Reference)

Safety Information

Hazard Codes 

Xi

Risk Statements 

36/37/38

Safety Statements 

26-36

HS Code 

29339900

1-Benzylazetidin-3-ol Usage And Synthesis

Uses

1-Benzylazetidin-3-ol has been utilized as a starting material in commercially synthesising azetidin-3-ol hydrochloride[1].

Synthesis

5.0 g of l, 3.52 g of methanesulphonyl chloride and 6 ml of triethylamine in 40 ml of dichloromethane were stirred together for 18 hours. The mixture was filtered and the solvent was evaporated under reduced pressure. The residue was purified by chromatography on silica gel using isopropanol in dichloromethane as eluent to give the mesylate of 1-benzylazetidin-3-ol, yield 4.25 g.

References

[1] V. V. R. M. Krishna Reddy. “Development of an Optimized Process for the Preparation of 1-Benzylazetidin-3-ol: An Industrially Important Intermediate for Substituted Azetidine.” Organic Process Research & Development 15 2 (2011): 462–466.

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