EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:57703 - 2-nitrophenolate

Default Structure
ChEBI IDCHEBI:57703
ChEBI Name2-nitrophenolate
Stars
DefinitionThe conjugate base of 2-nitrophenol; major apecies at pH 7.3.
Last Modified10 December 2014
DownloadsMolfile
FormulaC6H4NO3
Net Charge-1
Average Mass138.102
Monoisotopic Mass138.01967
SMILESO=[N+]([O-])c1ccccc1[O-]
InChIInChI=1S/C6H5NO3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H/p-1
InChIKeyIQUPABOKLQSFBK-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
2-nitrophenolate (CHEBI:57703) is a phenolate anion (CHEBI:50525)
2-nitrophenolate (CHEBI:57703) is conjugate base of 2-nitrophenol (CHEBI:16260)
Incoming Relation(s)
2-nitrophenol (CHEBI:16260) is conjugate acid of 2-nitrophenolate (CHEBI:57703)
IUPAC Name 
2-nitrophenolate
UniProt Name  Source
2-nitrophenolUniProt
Registry NumbersSources
Gmelin:327584Gmelin
Beilstein:3542179Beilstein