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

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ChEBI Name	4,4-dimethyloxazolidine-N-oxyl

ChEBI ID	CHEBI:184305

ChEBI ASCII Name	4,4-dimethyloxazolidine-N-oxyl

Definition	A member of the class of oxazolidines that is 4,4-dimethyl-1,3-oxazolidine carrying an oxidanediyl group at position 3.

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	Johannes Hunold (ORCID: 0000-0002-4378-6061)

Supplier Information

Download	Molfile XML SDF

Formula

C5H10NO2

Net Charge

Average Mass

116.139

Monoisotopic Mass

116.07115

InChI

InChI=1S/C5H10NO2/c1-5(2)3-8-4-6(5)7/h3-4H2,1-2H3

InChIKey

DCXJOVUZENRYSH-UHFFFAOYSA-N

SMILES

CC1(C)COCN1[O]

Roles Classification
Application(s):	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	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	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	Sources
(4,4-dimethyl-3-oxazolidinyloxy) radical	ChEBI
4,4-dimethyl-1,3-oxazolidin-3-yl-N-oxyl	ChEBI
4,4-dimethyl-3-oxazolidinyloxy	ChEBI
DOXYL	SUBMITTER
N-oxyl-4,4-dimethyloxazolidine	ChEBI

Registry Number	Type	Source
25554-61-4	CAS Registry Number	SUBMITTER

Last Modified

23 November 2021