skip to main content

Chemistry, part 2

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

organooxygen compound > carbonyl compound > ketone > aromatic ketone > 4-hydroxy-1-(3-pyridinyl)-1-butanone
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > 4-hydroxy-1-(3-pyridinyl)-1-butanone
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > 4-hydroxy-1-(3-pyridinyl)-1-butanone

Preferred term

4-hydroxy-1-(3-pyridinyl)-1-butanone  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C9H11NO2

inchi

  • InChI=1S/C9H11NO2/c11-6-2-4-9(12)8-3-1-5-10-7-8/h1,3,5,7,11H,2,4,6H2

inchikey

  • KTXUGZHJVRHQGP-UHFFFAOYSA-N

mass

  • 165.189

monoisotopicmass

  • 165.07898

smiles

  • N1=CC=CC(=C1)C(CCCO)=O

subset

  • 2_STAR

synonym RELATED

  • 4-hydroxy-1-(3-pyridyl)-1-butanone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:82563

Download this concept:

RDF/XML TURTLE JSON-LD