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CHEBI:231654 - 4,6-dinitroguaiacol

ChEBI IDCHEBI:231654
ChEBI Name4,6-dinitroguaiacol
Stars
DefinitionA dinitrophenol that is phenol substituted by a methoxy group at position 2 and nitro groups at positions 4 and 6.
Last Modified28 June 2024
Submitterjonmuyskens
DownloadsMolfile
FormulaC7H6N2O6
Net Charge0
Average Mass214.133
Monoisotopic Mass214.02259
SMILESCOc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O
InChIInChI=1S/C7H6N2O6/c1-15-6-3-4(8(11)12)2-5(7(6)10)9(13)14/h2-3,10H,1H3
InChIKeyASODNZCPFZQUKR-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4,6-dinitroguaiacol (CHEBI:231654) is a dinitrophenol (CHEBI:39352)
4,6-dinitroguaiacol (CHEBI:231654) is a guaiacols (CHEBI:134251)
IUPAC Name 
2-methoxy-4,6-dinitrophenol
Synonym  Source
6-methoxy-2,4-dinitrophenolChEBI
Manual XrefsDatabases
144810ChemSpider
Registry NumbersSources
CAS:4097-63-6ChEBI
Citations