1-Oxa-3,9-diazaspiro[5.5]undecan-2-one


Chemical Name: 1-Oxa-3,9-diazaspiro[5.5]undecan-2-one
CAS Number: 54981-11-2
Product Number: AG00DKU2(AGN-PC-03OKQ7)
Synonyms:
MDL No:
Molecular Formula: C8H14N2O2
Molecular Weight: 170.2090

Identification/Properties


Properties
BP:
410°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
170.212g/mol
XLogP3:
0
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
170.106g/mol
Monoisotopic Mass:
170.106g/mol
Topological Polar Surface Area:
50.4A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
188
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:
H302-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



1-Oxa-3,9-diazaspiro[5.5]undecan-2-one is a versatile compound that finds wide application in chemical synthesis. This heterocyclic compound is used as a building block in the creation of various pharmaceuticals and agrochemicals due to its unique structural properties. By incorporating 1-Oxa-3,9-diazaspiro[5.5]undecan-2-one into organic synthesis reactions, chemists can introduce a spirocyclic motif that imparts enhanced biological activity to the resulting molecules. This compound serves as an important intermediate in the synthesis of complex organic molecules with spirocyclic scaffolds, making it a valuable tool for medicinal and agricultural chemists looking to design novel compounds with improved properties.