EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:32063 - propylparaben

ChEBI IDCHEBI:32063
ChEBI Namepropylparaben
Stars
DefinitionThe benzoate ester that is the propyl ester of 4-hydroxybenzoic acid. Preservative typically found in many water-based cosmetics, such as creams, lotions, shampoos and bath products. Also used as a food additive.
Last Modified22 February 2017
DownloadsMolfile

FormulaC10H12O3
Net Charge0
Average Mass180.203
Monoisotopic Mass180.07864
SMILESCCCOC(=O)c1ccc(O)cc1
InChIInChI=1S/C10H12O3/c1-2-7-13-10(12)8-3-5-9(11)6-4-8/h3-6,11H,2,7H2,1H3
InChIKeyQELSKZZBTMNZEB-UHFFFAOYSA-N

Wikipedia
Roles Classification

ChEBI Ontology
IUPAC Name 
propyl 4-hydroxybenzoate
Synonyms  Source
n-Propyl p-hydroxybenzoateChemIDplus
4-Hydroxybenzoic acid, propyl esterChemIDplus
p-Hydroxybenzoic acid propyl esterChemIDplus
p-Oxybenzoesäurepropylester  deChemIDplus
Propyl p-hydroxybenzoateChemIDplus
Propyl parahydroxybenzoateChemIDplus
Manual XrefsDatabases
PropylparabenWikipedia
D01422KEGG DRUG
HMDB0032574HMDB
2307DrugCentral
Registry NumbersSources
Reaxys:1103245Reaxys
CAS:94-13-3KEGG DRUG
Citations