4-Oxazolidineacetic acid, 2,5-dioxo-, phenylmethyl ester, (S)-


Chemical Name: 4-Oxazolidineacetic acid, 2,5-dioxo-, phenylmethyl ester, (S)-
CAS Number: 13590-42-6
Product Number: AG003LY1(AGN-PC-0O191A)
Synonyms:
MDL No:
Molecular Formula: C12H11NO5
Molecular Weight: 249.2194

Identification/Properties


Properties
MP:
120-122 °C
Storage:
Inert atmosphere;-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
249.222g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
5
Exact Mass:
249.064g/mol
Monoisotopic Mass:
249.064g/mol
Topological Polar Surface Area:
81.7A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
348
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



L-Aspartic acid β-benzyl ester N-carboxylic acid anhydride is a versatile compound commonly used in chemical synthesis as a key reagent. It serves as an important building block in the production of various pharmaceuticals, agrochemicals, and fine chemicals due to its ability to facilitate the formation of peptide bonds. This compound enables the efficient synthesis of peptide chains, which are essential in the development of bioactive molecules such as peptides and proteins. Additionally, L-Aspartic acid β-benzyl ester N-carboxylic acid anhydride plays a crucial role in the modification of amino acids and the creation of peptide mimetics, offering scientists and researchers a valuable tool for designing novel compounds with enhanced biological activities.