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CHEBI:46875 - dinicotinic acid

ChEBI IDCHEBI:46875
ChEBI Namedinicotinic acid
Stars
Last Modified2 December 2009
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC7H5NO4
Net Charge0
Average Mass167.120
Monoisotopic Mass167.02186
SMILESO=C(O)c1cncc(C(=O)O)c1
InChIInChI=1S/C7H5NO4/c9-6(10)4-1-5(7(11)12)3-8-2-4/h1-3H,(H,9,10)(H,11,12)
InChIKeyMPFLRYZEEAQMLQ-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)
dinicotinic acid (CHEBI:46875) is a pyridinedicarboxylic acid (CHEBI:36112)
dinicotinic acid (CHEBI:46875) is conjugate acid of dinicotinate(1−) (CHEBI:46878)
Incoming Relation(s)
dinicotinate(1−) (CHEBI:46878) is conjugate base of dinicotinic acid (CHEBI:46875)
IUPAC Name 
pyridine-3,5-dicarboxylic acid
Synonyms  Source
3,5-pyridinedicarboxylic acidNIST Chemistry WebBook
5-carboxynicotinic acidNIST Chemistry WebBook
Dinicotinic acidChemIDplus
Registry NumbersSources
Beilstein:131640Beilstein
Gmelin:279307Gmelin
CAS:499-81-0NIST Chemistry WebBook
CAS:499-81-0ChemIDplus