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Chemical Structure| 917562-09-5 Chemical Structure| 917562-09-5

Structure of 3-Bromo-5-chlorobenzyl alcohol
CAS No.: 917562-09-5

Chemical Structure| 917562-09-5

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Product Details of [ 917562-09-5 ]

CAS No. :917562-09-5
Formula : C7H6BrClO
M.W : 221.48
SMILES Code : OCC1=CC(Cl)=CC(Br)=C1
MDL No. :MFCD08061830
InChI Key :XGBLROAPOAITNY-UHFFFAOYSA-N
Pubchem ID :17750953

Safety of [ 917562-09-5 ]

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

Application In Synthesis of [ 917562-09-5 ]

* 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 [ 917562-09-5 ]

[ 917562-09-5 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 917562-09-5 ]
  • [ 258331-10-1 ]
  • tert-butyl 2-(2-((3-bromo-5-chlorobenzyl)oxy)phenyl)acetate [ No CAS ]
YieldReaction ConditionsOperation in experiment
With di-isopropyl azodicarboxylate; triphenylphosphine; In tetrahydrofuran; at 0 - 20℃; for 16h;Inert atmosphere; Intermediate 3-A. tert-Butyl 2-(2-((3-bromo-5-chlorobenzyl)oxy)phenyl)acetate A solution of 3-bromo-5-chloro-benzyl alcohol (CAS 917562-09-5) (2.24 g, 10.1 1 mmol) and fe/ -butyl 2-(2-hydroxyphenyl) acetate (Intermediate 2, 2.74 g, 13.15 mmol) and PPh3 (3.45 g, 13.15 mmol) inTHF (50 mL) was cooled to 0 C in an ice/water bath under nitrogen. DIAD (2.56 ml, 13.15 mmol) was added dropwise. The resulting yellow solution was allowed to warm to room temperature and then stirred for 16 hours. Excess base was quenched with water and the resulting mixture was extracted with EtOAc (2X), washed with brine, dried with MgS04, filtered and concentrated. The residue was purified by silica gel chromatography (0-40% EtOAc/heptane) to provide the title compound. 1H NMR (400 MHz, CHLOROFORM-cf2) delta ppm 7.44 - 7.53 (m, 2 H) 7.38 (t, J=1 .64 Hz, 1 H) 7.17 - 7.24 (m, 2 H) 6.96 (d, J=1 .01 Hz, 1 H) 6.86 (d, J=8.21 Hz, 1 H) 5.02 (s, 2 H) 3.60 (s, 2 H) 1 .42 (s, 9 H).
 

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