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


Term:2,5-dimethylphenyl isocyanate
go back to main search page
Accession:CHEBI:60097 term browser browse the term
Definition:An isocyanate that consists of phenyl isocyanate bearing two additional methyl substituents at positions 2 and 5.
Synonyms:exact_synonym: 2-isocyanato-1,4-dimethylbenzene
 related_synonym: 2,5-dimethyl phenylisocyanate;   2,5-dimethylphenylisocyanate;   Formula=C9H9NO;   InChI=1S/C9H9NO/c1-7-3-4-8(2)9(5-7)10-6-11/h3-5H,1-2H3;   InChIKey=SOXVXJQIQVOCAY-UHFFFAOYSA-N;   SMILES=Cc1ccc(C)c(c1)N=C=O
 xref: Beilstein:1100841 "Beilstein";   CAS:40397-98-6 "ChemIDplus";   PMID:11708910 "Europe PMC";   PMID:20568997 "Europe PMC";   PMID:21878336 "Europe PMC";   PMID:23441814 "Europe PMC";   Reaxys:1100841 "Reaxys"

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 19764
    role 19711
      biological role 19710
        hapten 2975
          2,5-dimethylphenyl isocyanate 0
Path 2
Term Annotations click to browse term
  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
                                    2,5-dimethylphenyl isocyanate 0
paths to the root


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