CHEBI:44460 - naphthalene-2,6-dicarboxylic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name naphthalene-2,6-dicarboxylic acid
ChEBI ID CHEBI:44460
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:44459, CHEBI:33063
Supplier Information
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Formula C12H8O4
Net Charge 0
Average Mass 216.18952
Monoisotopic Mass 216.04226
InChI InChI=1S/C12H8O4/c13-11(14)9-3-1-7-5-10(12(15)16)4-2-8(7)6-9/h1-6H,(H,13,14)(H,15,16)
InChIKey RXOHFPCZGPKIRD-UHFFFAOYSA-N
SMILES OC(=O)c1ccc2cc(ccc2c1)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing naphthalene-2,6-dicarboxylic acid (CHEBI:44460) has parent hydride naphthalene (CHEBI:16482)
naphthalene-2,6-dicarboxylic acid (CHEBI:44460) is a dicarboxylic acid (CHEBI:35692)
IUPAC Name
naphthalene-2,6-dicarboxylic acid
Synonyms Sources
2,6-DICARBOXYNAPHTHALENE PDBeChem
2,6-naphthalenedicarboxylic acid ChemIDplus
2,6-naphthalic acid NIST Chemistry WebBook
Manual Xrefs Databases
DB08262 DrugBank
NDD PDBeChem
View more database links
Registry Numbers Types Sources
1141-38-4 CAS Registry Number NIST Chemistry WebBook
1141-38-4 CAS Registry Number ChemIDplus
1443903 Gmelin Registry Number Gmelin
2051257 Beilstein Registry Number Beilstein
Last Modified
05 September 2008