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CHEBI:184305 - 4,4-dimethyloxazolidine-N-oxyl

ChEBI IDCHEBI:184305
ChEBI Name4,4-dimethyloxazolidine-N-oxyl
Stars
ASCII Name4,4-dimethyloxazolidine-N-oxyl
DefinitionA member of the class of oxazolidines that is 4,4-dimethyl-1,3-oxazolidine carrying an oxidanediyl group at position 3.
Last Modified23 November 2021
SubmitterJohannes Hunold (ORCID: 0000-0002-4378-6061)
DownloadsMolfile
FormulaC5H10NO2
Net Charge0
Average Mass116.140
Monoisotopic Mass116.07115
SMILESCC1(C)COCN1[O]
InChIInChI=1S/C5H10NO2/c1-5(2)3-8-4-6(5)7/h3-4H2,1-2H3
InChIKeyDCXJOVUZENRYSH-UHFFFAOYSA-N
Roles Classification
Application:
spin label  A role played by a stable paramagnetic group that is attached to a part of a molecular entity whose microscopic environment is of interest and may be revealed by the electron spin resonance (ESR) spectroscopy.
ChEBI Ontology
Outgoing Relation(s)
4,4-dimethyloxazolidine-N-oxyl (CHEBI:184305) has role spin label (CHEBI:35210)
4,4-dimethyloxazolidine-N-oxyl (CHEBI:184305) is a aminoxyls (CHEBI:39477)
4,4-dimethyloxazolidine-N-oxyl (CHEBI:184305) is a oxazolidines (CHEBI:38329)
Incoming Relation(s)
16-DOXYL-stearic acid (CHEBI:184306) has functional parent 4,4-dimethyloxazolidine-N-oxyl (CHEBI:184305)
5-DOXYL-stearic acid (CHEBI:184308) has functional parent 4,4-dimethyloxazolidine-N-oxyl (CHEBI:184305)
IUPAC Name 
(4,4-dimethyl-1,3-oxazolidin-3-yl)oxidanyl
Synonyms  Source
DOXYLSUBMITTER
N-oxyl-4,4-dimethyloxazolidineChEBI
(4,4-dimethyl-3-oxazolidinyloxy) radicalChEBI
4,4-dimethyl-1,3-oxazolidin-3-yl-N-oxylChEBI
4,4-dimethyl-3-oxazolidinyloxyChEBI
Manual XrefsDatabases
8074471ChemSpider
HMDB0251604HMDB
Registry NumbersSources
CAS:25554-61-4SUBMITTER
Citations