skip to main content

Chemistry, part 1

Content language

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

Concept information

organooxygen compound > ester > carboxylic ester > benzoate ester > glycerol 1-hydroxy-2,5-dimethyl benzoate
organooxygen compound > carbonyl compound > carboxylic ester > benzoate ester > glycerol 1-hydroxy-2,5-dimethyl benzoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > phenols > glycerol 1-hydroxy-2,5-dimethyl benzoate
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > glycerol 1-hydroxy-2,5-dimethyl benzoate
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > organic hydroxy compound > phenols > glycerol 1-hydroxy-2,5-dimethyl benzoate
organic aromatic compound > phenols > glycerol 1-hydroxy-2,5-dimethyl benzoate

Preferred term

glycerol 1-hydroxy-2,5-dimethyl benzoate  

Type

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

Broader concept

charge

  • 0

formula

  • C12H16O5

has_functional_parent

inchi

  • InChI=1S/C12H16O5/c1-7-3-4-8(2)11(15)10(7)12(16)17-6-9(14)5-13/h3-4,9,13-15H,5-6H2,1-2H3/t9-/m0/s1

inchikey

  • WUPQQSPWBWLPND-VIFPVBQESA-N

mass

  • 240.255

monoisotopicmass

  • 240.09977

smiles

  • O=C(OC[C@@H](O)CO)C1=C(O)C(=CC=C1C)C

subset

  • 2_STAR

synonym EXACT

  • 2,3-dihydroxypropyl 2-hydroxy-3,6-dimethylbenzoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:227951

Download this concept:

RDF/XML TURTLE JSON-LD