CHEBI:34680 - dipentyl phthalate

ChEBI IDCHEBI:34680
ChEBI Namedipentyl phthalate
Stars
DefinitionA phthalate ester that is the dipentyl ester of benzene-1,2-dicarboxylic acid.
Last Modified24 August 2017
DownloadsMolfile
FormulaC18H26O4
Net Charge0
Average Mass306.402
Monoisotopic Mass306.18311
SMILESCCCCCOC(=O)c1ccccc1C(=O)OCCCCC
InChIInChI=1S/C18H26O4/c1-3-5-9-13-21-17(19)15-11-7-8-12-16(15)18(20)22-14-10-6-4-2/h7-8,11-12H,3-6,9-10,13-14H2,1-2H3
InChIKeyIPKKHRVROFYTEK-UHFFFAOYSA-N
Roles Classification
Applications:
plasticiser  Any compound that is used as an additive to increase the plasticity or fluidity of a substance, particularly but not exclusively to synthetic polymers.
endocrine disruptor  Any compound that can disrupt the functions of the endocrine (hormone) system
ChEBI Ontology
Outgoing Relation(s)
dipentyl phthalate (CHEBI:34680) has functional parent pentan-1-ol (CHEBI:44884)
dipentyl phthalate (CHEBI:34680) has role plasticiser (CHEBI:79056)
dipentyl phthalate (CHEBI:34680) is a diester (CHEBI:51307)
dipentyl phthalate (CHEBI:34680) is a phthalate ester (CHEBI:35484)
IUPAC Name 
dipentyl benzene-1,2-dicarboxylate
Synonyms  Source
Di-n-pentyl phthalateKEGG COMPOUND
Diamyl phthalateKEGG COMPOUND
DPNPChEBI
Amyl phthalateChemIDplus
Phthalic acid diamyl esterChemIDplus
1,2-Benzenedicarboxylic acid dipentyl esterChemIDplus
Manual XrefsDatabases
C14300KEGG COMPOUND
Registry NumbersSources
Reaxys:1987323Reaxys
CAS:131-18-0KEGG COMPOUND
CAS:131-18-0ChemIDplus
CAS:131-18-0NIST Chemistry WebBook
Citations