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Chemical Structure| 1016804-06-0 Chemical Structure| 1016804-06-0

Structure of 1016804-06-0

Chemical Structure| 1016804-06-0

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Product Details of [ 1016804-06-0 ]

CAS No. :1016804-06-0
Formula : C9H10BrNO
M.W : 228.09
SMILES Code : NC1CCOC2=C1C=CC(Br)=C2
MDL No. :MFCD28404667
InChI Key :XFJNBPPWJRERLH-UHFFFAOYSA-N
Pubchem ID :24710124

Safety of [ 1016804-06-0 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H312-H332
Precautionary Statements:P280

Application In Synthesis of [ 1016804-06-0 ]

* 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 [ 1016804-06-0 ]

[ 1016804-06-0 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 18442-22-3 ]
  • [ 1016804-06-0 ]
YieldReaction ConditionsOperation in experiment
5.2 g With methanol; ammonium acetate; sodium cyanoborohydride; In isopropyl alcohol; at 20 - 80℃; for 16h; To a solution of <strong>[18442-22-3]7-bromo-3,4-dihydro-2H-1-benzopyran-4-one</strong> (4.0 g, 17.6 mmol, 1.0 equiv) and NH4OAc (27.2 g, 353 mmol, 20.0 equiv) in a mixture of MeOH (40 mL) and i-PrOH (50 mL) was added NaBH3CN (5.5 g, 87.5 mmol, 5.0 equiv). The mixture was stirred at r.t. for 4 h and at 80 oC for 12 h, and concentrated to ~10 mL. The pH of the mixture was then adjusted to 8-9 with saturated NaHCO3 solution and mixed with EA (100 mL) and water (100 mL). The resulting solution was separated and the aqueous phase was extracted with EA (100 mL) four times. The combined organic layers were washed with brine (100 mL), dried over anhydrous sodium sulfate, and concentrated under reduced pressure to afford 5.2 g of 7-bromo-3,4-dihydro-2H-1-benzopyran-4-amine as light yellow oil.
 

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Related Functional Groups of
[ 1016804-06-0 ]

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Related Parent Nucleus of
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Other Aromatic Heterocycles

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