1,2,4-Oxadiazole, 3-methyl-5-(2S)-2-pyrrolidinyl-


Chemical Name: 1,2,4-Oxadiazole, 3-methyl-5-(2S)-2-pyrrolidinyl-
CAS Number: 343246-61-7
Product Number: AG003CM3(AGN-PC-0O94CY)
Synonyms:
MDL No: MFCD18071021
Molecular Formula: C7H11N3O
Molecular Weight: 153.1817

Identification/Properties


Properties
BP:
280.8°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Liquid
Computed Properties
Molecular Weight:
153.185g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
153.09g/mol
Monoisotopic Mass:
153.09g/mol
Topological Polar Surface Area:
51A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
142
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



(S)-3-methyl-5-(2-pyrrolidinyl)-1,2,4-oxadiazole, known for its unique chiral structure, plays a crucial role in chemical synthesis as a versatile building block. This compound is widely employed in asymmetric synthesis, aiding in the creation of complex molecules with high stereoselectivity. Its presence enhances the efficiency of various reactions such as catalysis, protecting group strategies, and functional group interconversions. With its specific stereochemistry, (S)-3-methyl-5-(2-pyrrolidinyl)-1,2,4-oxadiazole enables chemists to design and construct molecules of pharmaceutical, agrochemical, and material science significance.