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ONTOLOGY REPORT - ANNOTATIONS


Term:bis(2-ethylhexyl) phthalate
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Accession:CHEBI:17747 term browser browse the term
Definition:A phthalate ester that is the bis(2-ethylhexyl) ester of benzene-1,2-dicarboxylic acid.
Synonyms:exact_synonym: bis(2-ethylhexyl) benzene-1,2-dicarboxylate
 related_synonym: 1,2-Benzenedicarboxylic acid bis(2-ethylhexyl) ester;   2-Ethylhexyl phthalate;   Bis(2-ethylhexyl) o-phthalate;   Bis(ethylhexyl) phthalate;   DEHP;   Di(2-ethylhexyl) o-phthalate;   Di(2-ethylhexyl)orthophthalate;   Di(2-ethylhexyl)phthalate;   Di(ethylhexyl) phthalate;   Di-sec-octyl phthalate;   Diethylhexyl phthalate;   Dioctyl phthalate;   Formula=C24H38O4;   InChI=1S/C24H38O4/c1-5-9-13-19(7-3)17-27-23(25)21-15-11-12-16-22(21)24(26)28-18-20(8-4)14-10-6-2/h11-12,15-16,19-20H,5-10,13-14,17-18H2,1-4H3;   InChIKey=BJQHLKABXJIVAM-UHFFFAOYSA-N;   Octyl phthalate;   Phthalic acid bis(2-ethylhexyl) ester;   Phthalic acid di(2-ethylhexyl) ester;   SMILES=CCCCC(CC)COC(=O)c1ccccc1C(=O)OCC(CC)CCCC;   di-iso-Octyl phthalate
 alt_id: CHEBI:13911;   CHEBI:22889;   CHEBI:3116
 xref: Beilstein:1890696 "Beilstein";   CAS:117-81-7 "ChemIDplus";   CAS:117-81-7 "KEGG COMPOUND";   CAS:117-81-7 "NIST Chemistry WebBook";   KEGG:C03690
 xref_mesh: MESH:D004051
 xref: MetaCyc:BIS2-ETHYLHEXYLPHTHALATE;   PMID:12963402 "Europe PMC";   PMID:16874505 "Europe PMC";   PMID:17286146 "Europe PMC";   PMID:19211671 "Europe PMC";   PMID:19840837 "Europe PMC";   PMID:28199414 "Europe PMC";   PMID:28763719 "Europe PMC";   Reaxys:1890696 "Reaxys";   Wikipedia:Bis(2-ethylhexyl)_phthalate


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  CHEBI ontology 23759
    role 23648
      application 23045
        plasticiser 6929
          bis(2-ethylhexyl) phthalate 3364
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  CHEBI ontology 23759
    subatomic particle 23708
      composite particle 23708
        hadron 23708
          baryon 23708
            nucleon 23708
              atomic nucleus 23708
                atom 23708
                  main group element atom 23528
                    p-block element atom 23528
                      carbon group element atom 23239
                        carbon atom 23216
                          organic molecular entity 23216
                            organic group 21900
                              organic divalent group 21872
                                organodiyl group 21872
                                  carbonyl group 21844
                                    carbonyl compound 21844
                                      carboxylic acid 20889
                                        aromatic carboxylic acid 11289
                                          benzoic acids 11254
                                            benzenedicarboxylic acid 7725
                                              phthalic acid 7434
                                                phthalate ester 7434
                                                  bis(2-ethylhexyl) phthalate 3364
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