3-Azetidinecarboxylic acid, 1-(phenylmethyl)-


Chemical Name: 3-Azetidinecarboxylic acid, 1-(phenylmethyl)-
CAS Number: 94985-27-0
Product Number: AG005TLG(AGN-PC-0KPZM3)
Synonyms:
MDL No:
Molecular Formula: C11H13NO2
Molecular Weight: 191.2264

Identification/Properties


Properties
BP:
327.5 °C at 760 mmHg
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
191.23g/mol
XLogP3:
-1.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
191.094629g/mol
Monoisotopic Mass:
191.094629g/mol
Topological Polar Surface Area:
40.5Ų
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
205
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#:
N/A
Hazard Statements:
H315-H317-H319-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



3-Azetidinecarboxylic acid, 1-(phenylmethyl)- is a versatile compound that plays a crucial role in chemical synthesis. This compound is commonly used as a building block in organic synthesis due to its unique structure and reactivity. Its azetidine ring provides a stable and rigid framework for the construction of complex molecules.In chemical synthesis, 3-Azetidinecarboxylic acid, 1-(phenylmethyl)- is frequently employed as a key intermediate in the production of various pharmaceuticals, agrochemicals, and specialty chemicals. Its presence allows for the introduction of specific functional groups and substituents, enabling the creation of diverse molecular structures with desired properties.Furthermore, this compound serves as a valuable starting material for the synthesis of peptides, amino acids, and other biologically active compounds. Its incorporation in these processes enables chemists to efficiently access structurally diverse molecules with potential applications in medicinal chemistry and material science.Overall, 3-Azetidinecarboxylic acid, 1-(phenylmethyl)- serves as a fundamental component in the toolkit of synthetic chemists, facilitating the construction of intricate molecules and enabling the development of novel chemical entities with a wide range of applications.