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CHEBI:87270 - 2-(pentyloxy)ethyl acetate

ChEBI IDCHEBI:87270
ChEBI Name2-(pentyloxy)ethyl acetate
Stars
DefinitionAn acetate ester that is ethyl acetate substituted by a pentyloxy group at position 2.
Last Modified3 September 2015
Submitternamrata
DownloadsMolfile
FormulaC9H18O3
Net Charge0
Average Mass174.240
Monoisotopic Mass174.12559
SMILESCCCCCOCCOC(C)=O
InChIInChI=1S/C9H18O3/c1-3-4-5-6-11-7-8-12-9(2)10/h3-8H2,1-2H3
InChIKeyINRKVKPTZMIOTG-UHFFFAOYSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
2-(pentyloxy)ethyl acetate (CHEBI:87270) has role metabolite (CHEBI:25212)
2-(pentyloxy)ethyl acetate (CHEBI:87270) is a acetate ester (CHEBI:47622)
2-(pentyloxy)ethyl acetate (CHEBI:87270) is a ether (CHEBI:25698)
IUPAC Name 
2-(pentyloxy)ethyl acetate
Registry NumbersSources
Reaxys:1856516Reaxys