Metabolomics Structure Database

 
MW REGNO: 87172
Common Name:Diphenyl phosphate
Systematic Name:diphenyl hydrogen phosphate
RefMet Name:Diphenyl phosphate
Synonyms:Phosphoric acid diphenyl ester [PubChem Synonyms]
Exact Mass:
250.0395 (neutral)    Calculate m/z:
Formula:C12H11O4P
InChIKey:ASMQGLCHMVWBQR-UHFFFAOYSA-N
ClassyFire superclass:Organic acids and derivatives [C0000264]
ClassyFire class:Organic phosphoric acids and derivatives [C0000402]
ClassyFire subclass:Phosphate esters [C0000408]
ClassyFire direct parent:Aryl phosphodiesters [C0004618]
Massbank MS spectra:View MS spectra
SMILES:c1ccc(cc1)OP(=O)(O)Oc1ccccc1
Studies:Available studies (via RefMet name)

Select appropriate tab below to view additional details:

Calculated physicochemical properties:

No data available

References

LIPID MAPS classification: "Update of the LIPID MAPS comprehensive classification system for lipids", Fahy E, Subramaniam S, Murphy RC, Nishijima M, Raetz CR, Shimizu T, Spener F, van Meer G, Wakelam MJ, and Dennis EA, J. Lipid Res. (2009) 50: S9-S14. DOI: 10.1194/jlr.R800095-JLR200
ClassyFire classification: "ClassyFire: automated chemical classification with a comprehensive, computable taxonomy", Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS, J. Cheminformatics (2016) 8:61. DOI: 10.1186/s13321-016-0174-y

  logo