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ONTOLOGY REPORT - ANNOTATIONS


Term:hexamethylene diisocyanate
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Accession:CHEBI:53578 term browser browse the term
Definition:A diisocyanate compound with the two isocyanates linked by a hexane-1,6-diyl group.
Synonyms:related_synonym: 1,6-Diisocyanatohexane;   1,6-Hexamethylene diisocyanate;   1,6-Hexanediol diisocyanate;   1,6-Hexylene diisocyanate;   Formula=C8H12N2O2;   HDI;   HMDI;   Hexane 1,6-diisocyanate;   InChI=1S/C8H12N2O2/c11-7-9-5-3-1-2-4-6-10-8-12/h1-6H2;   InChIKey=RRAMGCGOFNQTLD-UHFFFAOYSA-N;   SMILES=O=C=NCCCCCCN=C=O
 xref: Beilstein:956709 "Beilstein";   CAS:822-06-0 "ChemIDplus";   CAS:822-06-0 "NIST Chemistry WebBook";   Gmelin:50636 "Gmelin"
 xref_mesh: MESH:C015262
 xref: PMID:11927838 "Europe PMC";   PMID:16731584 "Europe PMC";   PMID:17042142 "Europe PMC";   PMID:21878336 "Europe PMC";   PMID:22293954 "Europe PMC";   PMID:22419182 "Europe PMC";   PMID:22449630 "Europe PMC";   PMID:23178851 "Europe PMC";   PMID:23262421 "Europe PMC";   PMID:23421488 "Europe PMC";   PMID:24083673 "Europe PMC";   PMID:6296214 "Europe PMC";   Reaxys:956709 "Reaxys";   Wikipedia:Hexamethylene_diisocyanate


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  CHEBI ontology 223
    role 223
      biological role 223
        hapten 3
          hexamethylene diisocyanate 0
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  CHEBI ontology 223
    subatomic particle 223
      composite particle 223
        hadron 223
          baryon 223
            nucleon 223
              atomic nucleus 223
                atom 223
                  main group element atom 216
                    main group molecular entity 216
                      p-block molecular entity 216
                        carbon group molecular entity 205
                          organic molecular entity 204
                            heteroorganic entity 198
                              organochalcogen compound 168
                                organooxygen compound 167
                                  isocyanates 0
                                    diisocyanate 0
                                      hexamethylene diisocyanate 0
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