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CHEBI:46032 - benzene-1,3,5-tricarboxylic acid

ChEBI IDCHEBI:46032
ChEBI Namebenzene-1,3,5-tricarboxylic acid
Stars
DefinitionA tricarboxylic acid that consists of benzene substituted by carboxy groups at positions 1, 3 and 5.
Secondary ChEBI IDsCHEBI:33058, CHEBI:46030
Last Modified7 March 2018
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC9H6O6
Net Charge0
Average Mass210.141
Monoisotopic Mass210.01644
SMILESO=C(O)c1cc(C(=O)O)cc(C(=O)O)c1
InChIInChI=1S/C9H6O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H,(H,10,11)(H,12,13)(H,14,15)
InChIKeyQMKYBPDZANOJGF-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
benzene-1,3,5-tricarboxylic acid (CHEBI:46032) is a benzoic acids (CHEBI:22723)
benzene-1,3,5-tricarboxylic acid (CHEBI:46032) is a tricarboxylic acid (CHEBI:27093)
benzene-1,3,5-tricarboxylic acid (CHEBI:46032) is conjugate acid of benzene-1,3,5-tricarboxylate(1−) (CHEBI:33061)
Incoming Relation(s)
N,N',N''-tris(3-pyridyl)benzene-1,3,5-tricarboxamide (CHEBI:52612) has functional parent benzene-1,3,5-tricarboxylic acid (CHEBI:46032)
benzene-1,3,5-tricarboxylate(1−) (CHEBI:33061) is conjugate base of benzene-1,3,5-tricarboxylic acid (CHEBI:46032)
IUPAC Name 
benzene-1,3,5-tricarboxylic acid
Synonyms  Source
1,3,5-BENZENETRICARBOXYLIC ACIDPDBeChem
trimesic acidChemIDplus
trimesitinic acidNIST Chemistry WebBook
1,3,5-tricarboxybenzeneNIST Chemistry WebBook
5-carboxyisophthalic acidChemIDplus
trimesinic acidNIST Chemistry WebBook
Manual XrefsDatabases
TMMPDBeChem
DB08632DrugBank
Trimesic_acidWikipedia
Registry NumbersSources
Beilstein:2053080Beilstein
Gmelin:51147Gmelin
Reaxys:2053080Reaxys
CAS:554-95-0ChemIDplus
CAS:554-95-0NIST Chemistry WebBook
Citations