CHEBI:87362 - pentyl acetate

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ChEBI Name pentyl acetate
ChEBI ID CHEBI:87362
Definition An acetate ester of pentanol.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C7H14O2
Net Charge 0
Average Mass 130.18490
Monoisotopic Mass 130.099
InChI InChI=1S/C7H14O2/c1-3-4-5-6-9-7(2)8/h3-6H2,1-2H3
InChIKey PGMYKACGEOXYJE-UHFFFAOYSA-N
SMILES CCCCCOC(C)=O
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing pentyl acetate (CHEBI:87362) has functional parent pentan-1-ol (CHEBI:44884)
pentyl acetate (CHEBI:87362) has role metabolite (CHEBI:25212)
pentyl acetate (CHEBI:87362) is a acetate ester (CHEBI:47622)
IUPAC Name
pentyl acetate
Synonyms Sources
amyl acetate ChEBI
Amyl acetic ester NIST Chemistry WebBook
pentyl acetate UniProt
Registry Numbers Types Sources
1744753 Reaxys Registry Number Reaxys
628-63-7 CAS Registry Number NIST Chemistry WebBook
628-63-7 CAS Registry Number ChemIDplus
Last Modified
04 September 2017