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ONTOLOGY REPORT - ANNOTATIONS


Term:2-phenylethyl isocyanate
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Accession:CHEBI:60067 term browser browse the term
Definition:An isocyanate having a 2-phenylethyl group attached to the nitrogen.
Synonyms:exact_synonym: (2-isocyanatoethyl)benzene
 related_synonym: 2-Phenylethylisocyanate;   Formula=C9H9NO;   InChI=1S/C9H9NO/c11-8-10-7-6-9-4-2-1-3-5-9/h1-5H,6-7H2;   InChIKey=HACRKYQRZABURO-UHFFFAOYSA-N;   Phenylethyl isocyanate;   Phenylethylisocyanate;   SMILES=O=C=NCCc1ccccc1;   phenethyl isocyanate
 xref: Beilstein:1448240 "Beilstein";   CAS:1943-82-4 "ChemIDplus";   PMID:19840837 "Europe PMC";   PMID:20140730 "Europe PMC";   Reaxys:1448240 "Reaxys"


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Term Annotations click to browse term
  CHEBI ontology 19764
    role 19711
      biological role 19710
        hapten 2975
          2-phenylethyl isocyanate 0
Path 2
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  CHEBI ontology 19764
    subatomic particle 19762
      composite particle 19762
        hadron 19762
          baryon 19762
            nucleon 19762
              atomic nucleus 19762
                atom 19762
                  main group element atom 19646
                    p-block element atom 19646
                      carbon group element atom 19540
                        carbon atom 19529
                          organic molecular entity 19529
                            heteroorganic entity 19106
                              organochalcogen compound 18802
                                organooxygen compound 18713
                                  isocyanates 337
                                    2-phenylethyl isocyanate 0
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