113789-91-6

Basic information

• Product Name: 2-Pyrrolidinone,3-(2-propenyl)-(9CI)
• Synonyms: 2-Pyrrolidinone,3-(2-propenyl)-(9CI);3-(2-propen-1-yl)-2-Pyrrolidinone;3-prop-2-enylpyrrolidin-2-one
• CAS NO: 113789-91-6
• Molecular Formula: C₇H₁₁NO
• Molecular Weight: 125.16834
• Product Categories: PYRROLIDINE
• Mol File: 113789-91-6.mol
• Article Data: 4

Chemical Properties

• Melting Point: 58-59 °C
• Boiling Point: 262.4±9.0 °C(Predicted)
• Appearance: /
• Density: 0.959±0.06 g/cm3(Predicted)
• PKA: 16.54±0.40(Predicted)
• CAS DataBase Reference: 2-Pyrrolidinone,3-(2-propenyl)-(9CI)(CAS DataBase Reference)
• NIST Chemistry Reference: 2-Pyrrolidinone,3-(2-propenyl)-(9CI)(113789-91-6)
• EPA Substance Registry System: 2-Pyrrolidinone,3-(2-propenyl)-(9CI)(113789-91-6)

Safety Data

• Hazardous Substances Data: 113789-91-6(Hazardous Substances Data)

Usage

Description

2-Pyrrolidinone,3-(2-propenyl)-(9CI), also known as 2-(3-Propenyl) pyrrolidin-1-one or Vinyl tetrahydro-2-pyrrolone, is a pyrrolidinone-based chemical compound with a molecular formula of C8H13NO. It is a colorless liquid with a mild odor and is soluble in most organic solvents. 2-Pyrrolidinone,3-(2-propenyl)-(9CI) is commonly used as a precursor in the synthesis of various pharmaceuticals and agrochemicals. However, it is considered a potential irritant to the skin and eyes, necessitating careful handling in a controlled laboratory environment.

Uses

Used in Pharmaceutical Industry:
2-Pyrrolidinone,3-(2-propenyl)-(9CI) is used as a precursor in the synthesis of various pharmaceuticals for its ability to contribute to the development of new drugs and medicinal compounds.
Used in Agrochemical Industry:
2-Pyrrolidinone,3-(2-propenyl)-(9CI) is used as a precursor in the synthesis of various agrochemicals for its role in creating effective substances for agricultural applications, such as pesticides and herbicides.
Used in Chemical Research:
2-Pyrrolidinone,3-(2-propenyl)-(9CI) is utilized as a research compound in chemical laboratories for studying its properties and potential applications in the development of new chemical entities and materials.

Upstream product

• 178172-32-2 tert-butyl 3-allyl-2-oxopyrrolidine-1-carboxylate 
• 950849-45-3 ethyl 2-(2'-azidoethyl)pent-4-enoate 
• 224561-28-8 3-allyl-N-benzylpyrrolidin-2-one 
• 113789-88-1 2-(2-Azido-ethyl)-pent-4-enoic acid methyl ester 

Downstream Products

• 942413-08-3 C₁₆H₁₅F₆NO 
• 40296-20-6 1-methyl-3-(prop-2'-en-1'-yl)pyrrolidin-2-one 

Relevant articles and documents

Intramolecular and intermolecular Schmidt reactions of alkyl azides with aldehydes

Despite recent advances in the use of alkyl azides in ring expansion reactions of ketones, there has been little work done on the corresponding chemistry of aldehydes. In the present study, the Lewis acid-promoted reactions of alkyl azides with aldehydes

Photolysis of olefinic N-chloropyrrolidinones, N-chlorosuccinimides and N-chloro-oxazolidinones: Reactivity of cyclic carboxamidyl, imidyl and carbamyl radicals in intramolecular reactions

N-Chloro-alkenylpyrrolidinones, an N-chloro-alkenylsuccinimide and N- chloro-alkenyloxazolidinones were prepared as precursors of olefinic cyclic carboxamidyl, imidyl and carbamyl radicals constrained to undergo intramolecular reactions uniquely via their planar or slightly twisted (30- 35°) Π(N) state (1,5-transfer of an allylic hydrogen, 5-exo or 6-exo cyclization to give bicyclo[2.2.1]azaheptane and bicyclo[3.2.1]azaoctane skeletons respectively), those intramolecular reactions being unaccessible to the planar ΣN state. Their photolysis gave products arising uniquely from intermolecular reactions of those nitrogen radicals (addition to an external olefin, hydrogen abstraction from the solvent, allylic hydrogen abstraction). An intramolecular reaction leading to bicyclo[3.3.0]azaoctane derivatives via 5-exo cyclization was observed with an N-chloro-alkenylpyrrolidinone and an N-chloro-alkenyloxazolidinone. In these two cases, both the Π(N) and the Σ(N) states of the cyclic amidyl radical allow orbital overlap for 5-exo cyclization.