Submit Data |  Help |  Video Tutorials |  News |  Publications |  FTP Download |  REST API |  Citing RGD |  Contact   


go back to main search page
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"

show annotations for term's descendants       view all columns           Sort by:

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 225
    role 225
      chemical role 162
        explosive 7
          4-amino-2,6-dinitrotoluene 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 225
    subatomic particle 225
      composite particle 225
        hadron 225
          baryon 225
            nucleon 225
              atomic nucleus 225
                atom 225
                  main group element atom 218
                    main group molecular entity 218
                      s-block molecular entity 173
                        hydrogen molecular entity 171
                          hydrides 113
                            inorganic hydride 75
                              pnictogen hydride 74
                                nitrogen hydride 74
                                  azane 69
                                    ammonia 69
                                      organic amino compound 69
                                        aromatic amine 30
                                          anilines 16
                                            substituted aniline 13
                                              amino-nitrotoluene 0
                                                4-amino-2,6-dinitrotoluene 0
paths to the root


RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.