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Structure of 870812-95-6

Chemical Structure| 870812-95-6

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Product Details of [ 870812-95-6 ]

CAS No. :870812-95-6
Formula : C14H22N2OS
M.W : 266.40
SMILES Code : N[C@H](CCN1CCOCC1)CSC2=CC=CC=C2
MDL No. :MFCD17171370
InChI Key :XVHVBUNXLXLXKG-CYBMUJFWSA-N
Pubchem ID :25058453

Safety of [ 870812-95-6 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P305+P351+P338

Application In Synthesis of [ 870812-95-6 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Downstream synthetic route of [ 870812-95-6 ]

[ 870812-95-6 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 870812-94-5 ]
  • [ 870812-95-6 ]
YieldReaction ConditionsOperation in experiment
73% EXAMPLE 21F (1R)-3-(4-morpholinyl)-1-((phenylsulfanyl)methyl)propylamine A solution of EXAMPLE 21E (6.00 g, 21.4 mmol) in THF (80 mL) was heated to 55 C. and treated dropwise with a solution of 1M borane in THF (85 mL, 85.0 mmol) over a 1 hour period. The resulting reaction mixture was stirred at 55 C. for 18 hours, cooled to 0 C., treated dropwise with methanol (10 mL), treated with 150 mL additional methanol, and concentrated. The crude residue was dissolved in methanol (70 mL), treated with methanolic HCl (100 mL), and heated to reflux for 24 hours. The mixture was allowed to cool to room temperature, concentrated, diluted with 2M NaOH (200 mL), and extracted with ethyl acetate (3*250 mL). The combined extracts were washed with 1M NaOH and brine, dried (Na2SO4), filtered, concentrated, and purified by silica gel chromatography eluding with 5% triethylamine/10% methanol/0% acetonitrile/ethyl acetate to provide the desired product (3.45 g, 73%).
 

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[ 870812-95-6 ]

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