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ONTOLOGY REPORT - ANNOTATIONS


Term:4-amino-2,6-dinitrotoluene
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Accession:CHEBI:77424 term browser browse the term
Definition:An amino-nitrotoluene that is 2,6-dinitrotoluene substituted at position 4 by an amino group.
Synonyms:exact_synonym: 4-methyl-3,5-dinitroaniline
 related_synonym: 2,6-Dinitro-4-aminotoluene;   3,5-Dinitro-4-methylaniline;   3,5-Dinitro-p-toluidine;   4-ADNT;   4-Amino-1-methyl-2,6-dinitrobenzene;   4-Methyl-3,5-dinitrobenzenamine;   4-Methyl-3,5-dinitrophenylamine;   Formula=C7H7N3O4;   InChI=1S/C7H7N3O4/c1-4-6(9(11)12)2-5(8)3-7(4)10(13)14/h2-3H,8H2,1H3;   InChIKey=KQRJATLINVYHEZ-UHFFFAOYSA-N;   NSC 25010;   SMILES=Cc1c(cc(N)cc1[N+]([O-])=O)[N+]([O-])=O
 alt_id: CHEBI:20306
 xref: Beilstein:2462150 "ChemIDplus";   CAS:19406-51-0 "ChemIDplus";   CAS:19406-51-0 "KEGG COMPOUND";   CAS:19406-51-0 "NIST Chemistry WebBook";   KEGG:C16394
 xref_mesh: MESH:C035207
 xref: MetaCyc:CPD-10455;   PMID:11467731 "Europe PMC";   PMID:15081777 "Europe PMC";   PMID:15820102 "Europe PMC";   PMID:20390867 "Europe PMC";   PMID:23983501 "Europe PMC";   PMID:24234379 "Europe PMC";   PMID:3378017 "Europe PMC";   PMID:9198535 "Europe PMC";   Reaxys:2462150 "Reaxys";   UM-BBD_compID:c0455 "UM-BBD"


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  CHEBI ontology 0
    role 0
      chemical role 0
        explosive 0
          4-amino-2,6-dinitrotoluene 0
Path 2
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    main group molecular entity 0
                      s-block molecular entity 0
                        hydrogen molecular entity 0
                          hydrides 0
                            inorganic hydride 0
                              pnictogen hydride 0
                                nitrogen hydride 0
                                  azane 0
                                    ammonia 0
                                      organic amino compound 0
                                        aromatic amine 0
                                          anilines 0
                                            substituted aniline 0
                                              amino-nitrotoluene 0
                                                4-amino-2,6-dinitrotoluene 0
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