TERT-BUTYL 1-OXA-4,9-DIAZASPIRO[5.5]UNDECANE-9-CARBOXYLATE


Chemical Name: TERT-BUTYL 1-OXA-4,9-DIAZASPIRO[5.5]UNDECANE-9-CARBOXYLATE
CAS Number: 930785-40-3
Product Number: AG0065YB(AGN-PC-09Q68K)
Synonyms:
MDL No:
Molecular Formula: C13H24N2O3
Molecular Weight: 256.3413

Identification/Properties


Properties
BP:
364.2°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
256.346g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
256.179g/mol
Monoisotopic Mass:
256.179g/mol
Topological Polar Surface Area:
50.8A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
304
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-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



9-Boc-1-oxa-4,9-diazaspiro[5.5]undecane is a versatile compound widely utilized in chemical synthesis for its unique properties and applications. This compound plays a crucial role in organic chemistry as a building block for the synthesis of various pharmaceuticals, agrochemicals, and advanced materials.With its spirocyclic structure, 9-Boc-1-oxa-4,9-diazaspiro[5.5]undecane serves as a key intermediate in the preparation of complex molecules, thanks to its ability to introduce structural diversity and enhance molecular complexity. Furthermore, its Boc (tert-butoxycarbonyl) protecting group offers selective reactivity in various reactions, aiding in the controlled modification of functional groups during multi-step synthesis processes.In particular, this compound is widely employed in the synthesis of heterocyclic compounds, such as spiropiperidines, which are crucial scaffolds in drug discovery and development. Its efficient incorporation into target molecules allows for the creation of novel organic compounds with enhanced biological activities and pharmacological properties.Moreover, 9-Boc-1-oxa-4,9-diazaspiro[5.5]undecane's stability and compatibility with a wide range of reaction conditions make it a valuable tool for chemists in designing and executing complex chemical transformations. Overall, its strategic role in chemical synthesis makes it an indispensable component in the toolkit of synthetic chemists aiming to develop innovative molecules for various applications.