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CS-W001157 4
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1-(Pyrrolidin-1-yl)prop-2-en-1-one

  • CAS No. 42104-70-1

  • Cat. No. CS-0225509
  • Purity≥96%
  • MDL No.None

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

1-(Pyrrolidin-1-yl)prop-2-en-1-one|CS-0225509

Structure of 42104-70-1

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General Information

  • CAS No. 42104-70-1
  • Cat. No. CS-0225509
  • Purity ≥96%
  • MDL No. None
  • Storage -20°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₁NO
  • Molecular Weight 125.17
  • Synonym(s) N,N-Tetramethyleneacrylamide
  • SMILES C=CC(N1CCCC1)=O

Description

1-(Pyrrolidin-1-yl)prop-2-en-1-one features a conjugated enone system linked to a pyrrolidine nitrogen, delivering high reactivity in nucleophilic addition and Michael addition processes. This electron-deficient acrylate derivative integrates readily into synthetic scaffolds requiring efficient C–C bond formation under mild conditions. The pyrrolidine moiety enhances solubility and facilitates downstream functionalization.

Application

1-(Pyrrolidin-1-yl)prop-2-en-1-one serves as a versatile Michael acceptor and enamine building block in synthetic organic chemistry. Its conjugated enone system enables efficient nucleophilic addition reactions, particularly with amines, thiols, and carbon nucleophiles. The pyrrolidine moiety enhances reactivity while maintaining bench stability, facilitating straightforward purification and integration into multi-step syntheses of heterocyclic scaffolds and functionalized intermediates.

Safety Information

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GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 1760
Class : 8
Packing Group : Ⅲ
Hazard Statements : H302-H315-H318-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   20.31
  • LogP   0.7948
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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