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CHEBI:34709 - Diisodecyl phthalate

ChEBI IDCHEBI:34709
ChEBI NameDiisodecyl phthalate
Stars
Last Modified12 May 2016
DownloadsMolfile
FormulaC28H46O4
Net Charge0
Average Mass446.672
Monoisotopic Mass446.33961
SMILESCC(C)CCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCC(C)C
InChIInChI=1S/C28H46O4/c1-23(2)17-11-7-5-9-15-21-31-27(29)25-19-13-14-20-26(25)28(30)32-22-16-10-6-8-12-18-24(3)4/h13-14,19-20,23-24H,5-12,15-18,21-22H2,1-4H3
InChIKeyZVFDTKUVRCTHQE-UHFFFAOYSA-N
Roles Classification
Application:
endocrine disruptor  Any compound that can disrupt the functions of the endocrine (hormone) system
ChEBI Ontology
Outgoing Relation(s)
Diisodecyl phthalate (CHEBI:34709) is a diester (CHEBI:51307)
Diisodecyl phthalate (CHEBI:34709) is a phthalate ester (CHEBI:35484)
Synonym  Source
Diisodecyl phthalateKEGG COMPOUND
Manual XrefsDatabases
C14578KEGG COMPOUND
Registry NumbersSources
CAS:26761-40-0KEGG COMPOUND