EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:91048 - phenyl hydrogen phosphonate

ChEBI IDCHEBI:91048
ChEBI Namephenyl hydrogen phosphonate
Stars
DefinitionAn aryl phosphate resulting from the formal condensation of phosphonic acid with 1 mol eq. of phenol
Last Modified2 February 2016
SubmitterSteve
DownloadsMolfile
FormulaC6H7O3P
Net Charge0
Average Mass158.093
Monoisotopic Mass158.01328
SMILES[H]P(=O)(O)Oc1ccccc1
InChIInChI=1S/C6H7O3P/c7-10(8)9-6-4-2-1-3-5-6/h1-5,10H,(H,7,8)
InChIKeyNQRYGPXAYYDKJB-UHFFFAOYSA-N
Roles Classification
Application:
chromogenic compound  Colourless, endogenous or exogenous pigment precursors that may be transformed by biological mechanisms into coloured compounds. They are used in biochemical assays and in diagnosis as indicators, particularly in the form of enzyme substrates.
ChEBI Ontology
Outgoing Relation(s)
phenyl hydrogen phosphonate (CHEBI:91048) has functional parent phenol (CHEBI:15882)
phenyl hydrogen phosphonate (CHEBI:91048) has role chromogenic compound (CHEBI:75050)
phenyl hydrogen phosphonate (CHEBI:91048) is a aryl phosphonate (CHEBI:91046)
IUPAC Name 
phenyl hydrogen phosphonate
Synonyms  Source
phenyl phosphonateChEBI
monophenyl phosphonateChEBI
phosphonic acid monophenyl esterChEBI
Registry NumbersSources
Reaxys:1863788Reaxys
CAS:2310-89-6ChemIDplus