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Chemical Structure| 217192-22-8 Chemical Structure| 217192-22-8

Structure of 217192-22-8

Chemical Structure| 217192-22-8

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Product Details of [ 217192-22-8 ]

CAS No. :217192-22-8
Formula : C12H11NO
M.W : 185.22
SMILES Code : OCC1=CC=C(C2=CC=NC=C2)C=C1
MDL No. :MFCD04114576
InChI Key :JTQRRRUVWBLIFL-UHFFFAOYSA-N
Pubchem ID :2795556

Safety of [ 217192-22-8 ]

GHS Pictogram:
Signal Word:Danger
Hazard Statements:H302-H315-H318-H335
Precautionary Statements:P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P310-P330-P332+P313-P362-P403+P233-P405-P501
Class:8
UN#:1759
Packing Group:

Application In Synthesis of [ 217192-22-8 ]

* 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 [ 217192-22-8 ]

[ 217192-22-8 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 4385-76-6 ]
  • [ 217192-22-8 ]
YieldReaction ConditionsOperation in experiment
60% With lithium aluminium tetrahydride; In tetrahydrofuran; at 0 - 20℃; for 3h;Inert atmosphere; Under nitrogen atmosphere, to a cooled (0 °C), stirred suspension of LiA1H4 (2.0 M inTHF, 5.02 mL, 10.05 mmol) in dry THF (40 mL), commercially available 4-(4-pyridyl)-benzoic acid (0.5 g, 2.51 mmol) was added in one portion. The resulting mixture was stirred at r.t. for 3 h, then cooled to 0 °C and H20 (0.38 mL) was slowly and cautiously added, followed by a 3.0 M KOH solution (0.38 mL) and additional H20 (1.2 mL). The mixture was stirred at 0 °C for 1 h, filtered and the organic phase dried over Na2SO4 and concentrated to dryness affording the titlecompound (0.28 g, 60percent) as a yellow solid, which was used in the next step without any further purification. R= 1.40 mm. MS (ESI) m/z: 186 [M-H]. ?H NMR (DMSO-d6): oe 8.63-8.61 (m, 2H), 7.80-7.75 (m, 2H), 7.72-7.68 (m, 2H), 7.48-7.44 (m, 2H), 5.27 (t, 1H, J= 5.7 Hz), 4.56 (d, 1H, J= 5.7 Hz).
 

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