Pyrrolidine, 1-(chloroacetyl)-


Chemical Name: Pyrrolidine, 1-(chloroacetyl)-
CAS Number: 20266-00-6
Product Number: AG0028D8(AGN-PC-0JLXFH)
Synonyms:
MDL No:
Molecular Formula: C6H10ClNO
Molecular Weight: 147.6027

Identification/Properties


Computed Properties
Molecular Weight:
147.602g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
147.045g/mol
Monoisotopic Mass:
147.045g/mol
Topological Polar Surface Area:
20.3A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
110
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-Chloro-1-(pyrrolidin-1-yl)ethanone is a versatile chemical compound that finds wide applications in organic synthesis. Known for its reactivity and functional group compatibility, this compound is particularly valued for its role as a key intermediate in the synthesis of various pharmaceuticals, agrochemicals, and fine chemicals.In chemical synthesis, 2-Chloro-1-(pyrrolidin-1-yl)ethanone serves as a crucial building block for the construction of complex molecules. Its unique structure enables it to participate in a variety of reactions, including nucleophilic substitution, acylation, and ring-closure reactions. This compound is frequently utilized in the pharmaceutical industry to introduce the pyrrolidine ring scaffold into drug candidates, as well as to modify existing molecules for structure-activity relationship studies.Additionally, 2-Chloro-1-(pyrrolidin-1-yl)ethanone plays a significant role in the synthesis of heterocyclic compounds, which are essential structural motifs in many biologically active molecules. Its reactivity towards a range of nucleophiles and electrophiles makes it a valuable tool for creating diverse chemical structures with controlled stereochemistry.Overall, the application of 2-Chloro-1-(pyrrolidin-1-yl)ethanone in chemical synthesis underscores its importance in the preparation of complex organic molecules with potential therapeutic or industrial significance.