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CHEBI:195421 - 1,3-dodecanediol

ChEBI IDCHEBI:195421
ChEBI Name1,3-dodecanediol
Stars
DefinitionA medium-chain primary fatty alcohol that is dodecane carrying hydroxy groups at positions 1 and 3.
Last Modified31 October 2023
Submitterlaimo
DownloadsMolfile
FormulaC12H26O2
Net Charge0
Average Mass202.338
Monoisotopic Mass202.19328
SMILESCCCCCCCCCC(O)CCO
InChIInChI=1S/C12H26O2/c1-2-3-4-5-6-7-8-9-12(14)10-11-13/h12-14H,2-11H2,1H3
InChIKeyGVEPAEOOBURRFW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1,3-dodecanediol (CHEBI:195421) is a dodecanediol (CHEBI:195615)
1,3-dodecanediol (CHEBI:195421) is a medium-chain primary fatty alcohol (CHEBI:142605)
1,3-dodecanediol (CHEBI:195421) is a secondary fatty alcohol (CHEBI:167095)
IUPAC Name 
dodecane-1,3-diol
Synonym  Source
1,3-dihydroxydodecaneSUBMITTER
UniProt Name  Source
1,3-dodecanediolUniProt
Registry NumbersSources
CAS:39516-24-0NIST Chemistry WebBook
Citations