CHEBI:91050 - p-nitrophenyl phenyl phosphonate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name p-nitrophenyl phenyl phosphonate
ChEBI ID CHEBI:91050
ChEBI ASCII Name p-nitrophenyl phenyl phosphonate
Definition An aryl phosphate resulting from the formal condensation of phosphonic acid with 1 mol eq. each of phenol and 4-nitrophenol.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C12H10NO5P
Net Charge 0
Average Mass 279.186
Monoisotopic Mass 279.02966
InChI InChI=1S/C12H10NO5P/c14-13(15)10-6-8-12(9-7-10)18-19(16)17-11-4-2-1-3-5-11/h1-9,19H
InChIKey YGTLRZOYPNTDJW-UHFFFAOYSA-N
SMILES C1=CC=C(C=C1)OP(=O)(OC=2C=CC(=CC2)[N+]([O-])=O)[H]
Roles Classification
Application(s): 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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing p-nitrophenyl phenyl phosphonate (CHEBI:91050) has functional parent 4-nitrophenol (CHEBI:16836)
p-nitrophenyl phenyl phosphonate (CHEBI:91050) has functional parent phenol (CHEBI:15882)
p-nitrophenyl phenyl phosphonate (CHEBI:91050) has role chromogenic compound (CHEBI:75050)
p-nitrophenyl phenyl phosphonate (CHEBI:91050) is a aryl phosphonate (CHEBI:91046)
IUPAC Name
4-nitrophenyl phenyl phosphonate
Last Modified
02 February 2016