CHEBI:35595 - isoxazole

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ChEBI Name isoxazole
ChEBI ID CHEBI:35595
Definition A monocyclic heteroarene with a structure consisting of a 5-membered ring containing three carbon atoms and an oxygen and nitrogen atom adjacent to each other. It is the parent of the class of isoxazoles.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C3H3NO
Net Charge 0
Average Mass 69.06200
Monoisotopic Mass 69.021
InChI InChI=1S/C3H3NO/c1-2-4-5-3-1/h1-3H
InChIKey CTAPFRYPJLPFDF-UHFFFAOYSA-N
SMILES c1cnoc1
ChEBI Ontology
Outgoing isoxazole (CHEBI:35595) is a isoxazoles (CHEBI:55373)
isoxazole (CHEBI:35595) is a mancude organic heteromonocyclic parent (CHEBI:35555)
isoxazole (CHEBI:35595) is a monocyclic heteroarene (CHEBI:38179)
IUPAC Name
1,2-oxazole
Synonyms Sources
1-oxa-2-azacyclopentadiene NIST Chemistry WebBook
isooxazole NIST Chemistry WebBook
isoxazole ChemIDplus
Manual Xref Database
Isoxazole Wikipedia
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Registry Numbers Types Sources
103773 Reaxys Registry Number Reaxys
103773 Beilstein Registry Number Beilstein
1041679 Gmelin Registry Number Gmelin
288-14-2 CAS Registry Number ChemIDplus
288-14-2 CAS Registry Number NIST Chemistry WebBook
Last Modified
17 February 2014