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Chemical Structure| 89996-01-0 Chemical Structure| 89996-01-0

Structure of 89996-01-0

Chemical Structure| 89996-01-0

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Product Details of [ 89996-01-0 ]

CAS No. :89996-01-0
Formula : C21H23BrNP
M.W : 400.29
SMILES Code : NCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]
MDL No. :MFCD30470089

Safety of [ 89996-01-0 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H315-H319-H335
Precautionary Statements:P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P362-P403+P233-P501

Application In Synthesis of [ 89996-01-0 ]

* 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 [ 89996-01-0 ]

[ 89996-01-0 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 207399-07-3 ]
  • [ 89996-01-0 ]
  • C57H66N3P(2+)*I(1-)*Br(1-) [ No CAS ]
YieldReaction ConditionsOperation in experiment
39% With triethylamine; In dichloromethane; N,N-dimethyl-formamide; at 85℃; for 4h;Inert atmosphere; Analytical balance accurately weighs a certain amount of IR780,It was dissolved in a mixed solvent of anhydrous N,N-dimethylformamide (DMF) and anhydrous dichloromethane, and placed in a double-necked flask.Weigh a certain amount of TPP-NH2 (References CJZhang, JGWang, JBZhang, YMLee, GXFeng, TKLim, HMShen, QSLin, B.Liu, Mechanism-guided design and synthesis of a mitochondria-targeting Artemisinin analoguewith enhanced anticancer activity, Angew.Chem.Int.Ed.2016,55,13770.Synthesis),Dissolved in DMF, added to the above stirred solution of IR780, and added triethylamine,The reaction was carried out under nitrogen at 85 C for 4 hours.The ratio of the substance of IR780:TPP-NH2:TEA is 1:2:4.After completion of the reaction, anhydrous DMF and methylene chloride were evaporated and evaporated.The crude product was dissolved in methanol, and the mixture was purified by silica gel column chromatographyThe elution procedure is 100:1→90:1→80:1→70:1→60:1→50:1→40:1→30:1→20:1→10:1,When the ratio becomes 10:1, the product is eluted.The pure product of T780 was obtained as a blue solid with a yield of 39%.
 

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