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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
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;   CAS:117-81-7;   KEGG:C03690
 xref_mesh: MESH:D004051
 xref: MetaCyc:BIS2-ETHYLHEXYLPHTHALATE;   PMID:12963402;   PMID:16874505;   PMID:17286146;   PMID:19211671;   PMID:19840837;   PMID:28199414;   PMID:28763719;   Reaxys:1890696;   Wikipedia:Bis(2-ethylhexyl)_phthalate


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  CHEBI ontology 5052
    role 5044
      application 863
        plasticiser 0
          bis(2-ethylhexyl) phthalate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 5052
    subatomic particle 5043
      composite particle 5043
        hadron 5071
          baryon 5043
            nucleon 5043
              atomic nucleus 5043
                atom 5043
                  main group element atom 5013
                    p-block element atom 5010
                      carbon group element atom 4927
                        carbon atom 4954
                          organic molecular entity 4926
                            heteroorganic entity 4768
                              organochalcogen compound 4730
                                organooxygen compound 4692
                                  carbon oxoacid 368
                                    carboxylic acid 364
                                      aromatic carboxylic acid 136
                                        benzoic acids 138
                                          benzenedicarboxylic acid 39
                                            phthalic acid 39
                                              phthalate ester 40
                                                bis(2-ethylhexyl) phthalate 0
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