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CS-W001157 4
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2-Chloro-1-(1h-pyrrol-2-yl)ethanone

  • CAS No. 53391-62-1

  • Cat. No. CS-0117156
  • Molecule weight143.57
  • Purity≥97%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

2-Chloro-1-(1h-pyrrol-2-yl)ethanone|CS-0117156

Structure of 53391-62-1

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General Information

  • CAS No. 53391-62-1
  • Cat. No. CS-0117156
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₆ClNO
  • Molecular Weight 143.57
  • Synonym(s) Ketone, chloromethyl pyrrol-2-yl
  • SMILES ClCC(C1=CC=CN1)=O

Synthesis

  • Route1
    • null|null
      109-97-7
    • null|null
      79-04-9
    • ~79%
    • 2-Chloro-1-(1h-pyrrol-2-yl)ethanone|CS-0117156
      53391-62-1

    References

    • Zhang, Shuguang; Feng, Chengliang; Cai, Jin; Chen, Junqing; Hu, Huayou; Ji, Min Journal of Chemical Research, 2013 , vol. 37, # 8 p. 480 - 482
  • Route2

    References

    • Croce, Piero Dalla; Ferraccioli, Rafaella; Ritieni, Alberto Synthesis, 1990 , # 3 p. 212 - 213
  • Route3
    • null|null
      109-97-7
    • null|null
      107-14-2
    • ~%
    • 2-Chloro-1-(1h-pyrrol-2-yl)ethanone|CS-0117156
      53391-62-1

    References

    • Knott Journal of the Chemical Society, 1947 , p. 1656,1658 Full Text Show Details Blicke et al. Journal of the American Chemical Society, 1943 , vol. 65, p. 2465

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅲ
Hazard Statements : H314
Precautionary Statements : P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   32.86
  • LogP   1.4362
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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