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CHEBI:34710 - Diisooctyl phthalate

ChEBI IDCHEBI:34710
ChEBI NameDiisooctyl phthalate
Stars
Last Modified12 May 2016
DownloadsMolfile
FormulaC24H38O4
Net Charge0
Average Mass390.564
Monoisotopic Mass390.27701
SMILESCC(C)CCCCCOC(=O)c1ccccc1C(=O)OCCCCCC(C)C
InChIInChI=1S/C24H38O4/c1-19(2)13-7-5-11-17-27-23(25)21-15-9-10-16-22(21)24(26)28-18-12-6-8-14-20(3)4/h9-10,15-16,19-20H,5-8,11-14,17-18H2,1-4H3
InChIKeyIJFPVINAQGWBRJ-UHFFFAOYSA-N
Roles Classification
Application:
endocrine disruptor  Any compound that can disrupt the functions of the endocrine (hormone) system
ChEBI Ontology
Outgoing Relation(s)
Diisooctyl phthalate (CHEBI:34710) is a diester (CHEBI:51307)
Diisooctyl phthalate (CHEBI:34710) is a phthalate ester (CHEBI:35484)
Synonym  Source
Diisooctyl phthalateKEGG COMPOUND
Manual XrefsDatabases
C14577KEGG COMPOUND
Registry NumbersSources
CAS:27554-26-3KEGG COMPOUND