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CHEBI:77107 - 3-[(1-carboxyvinyl)oxy]benzoic acid

ChEBI IDCHEBI:77107
ChEBI Name3-[(1-carboxyvinyl)oxy]benzoic acid
Stars
DefinitionA dicarboxylic acid that is benzoic acid in which the hydrogen at position 3 is replaced by a (1-carboxyvinyl)oxy group.
Last Modified27 January 2014
SubmitterSteve
DownloadsMolfile
FormulaC10H8O5
Net Charge0
Average Mass208.169
Monoisotopic Mass208.03717
SMILESC=C(Oc1cccc(C(=O)O)c1)C(=O)O
InChIInChI=1S/C10H8O5/c1-6(9(11)12)15-8-4-2-3-7(5-8)10(13)14/h2-5H,1H2,(H,11,12)(H,13,14)
InChIKeyHGVAHYJMDVROLE-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
3-[(1-carboxyvinyl)oxy]benzoic acid (CHEBI:77107) has functional parent acrylic acid (CHEBI:18308)
3-[(1-carboxyvinyl)oxy]benzoic acid (CHEBI:77107) is a aromatic ether (CHEBI:35618)
3-[(1-carboxyvinyl)oxy]benzoic acid (CHEBI:77107) is a benzoic acids (CHEBI:22723)
3-[(1-carboxyvinyl)oxy]benzoic acid (CHEBI:77107) is a dicarboxylic acid (CHEBI:35692)
3-[(1-carboxyvinyl)oxy]benzoic acid (CHEBI:77107) is a enol ether (CHEBI:47985)
3-[(1-carboxyvinyl)oxy]benzoic acid (CHEBI:77107) is conjugate acid of 3-[(1-carboxylatovinyl)oxy]benzoate(2−) (CHEBI:76981)
Incoming Relation(s)
3-[(1-carboxylatovinyl)oxy]benzoate(2−) (CHEBI:76981) is conjugate base of 3-[(1-carboxyvinyl)oxy]benzoic acid (CHEBI:77107)
Synonym  Source
3-[(1-carboxyvinyl)oxy]benzoic acidChEBI
Registry NumbersSources
Reaxys:2373061Reaxys
Citations