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CHEBI:71527 - 5-[(2-methoxyphenyl)(methyl)phosphoryl]pent-4-ynoic acid

ChEBI IDCHEBI:71527
ChEBI Name5-[(2-methoxyphenyl)(methyl)phosphoryl]pent-4-ynoic acid
Stars
DefinitionA phosphine oxide in which the substituents on phosphorus are 4-carboxybut-1-yn-1-yl, methyl and 2-methoxyphenyl.
Last Modified2 May 2013
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC13H15O4P
Net Charge0
Average Mass266.233
Monoisotopic Mass266.07080
SMILESCOc1ccccc1[P+](C)([O-])C#CCCC(=O)O
InChIInChI=1S/C13H15O4P/c1-17-11-7-3-4-8-12(11)18(2,16)10-6-5-9-13(14)15/h3-4,7-8H,5,9H2,1-2H3,(H,14,15)
InChIKeySMTDVDJOIAAHAZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5-[(2-methoxyphenyl)(methyl)phosphoryl]pent-4-ynoic acid (CHEBI:71527) is a acetylenic compound (CHEBI:73474)
5-[(2-methoxyphenyl)(methyl)phosphoryl]pent-4-ynoic acid (CHEBI:71527) is a phosphine oxide (CHEBI:59656)
IUPAC Name 
5-[(2-methoxyphenyl)(methyl)phosphoryl]pent-4-ynoic acid
Synonym  Source
(4-carboxybut-1-yn-1-yl)(2-methoxyphenyl)methylphosphoniumolateIUPAC
Citations