CHEBI:73914 - 3,5-dinitrobenzoic acid

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 3,5-dinitrobenzoic acid ChEBI ID CHEBI:73914 Definition A member of the class of benzoic acids that is benzoic acid in which the hydrogens at positions 3 and 5 are replaced by nitro groups. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C7H4N2O6 Net Charge 0 Average Mass 212.11650 Monoisotopic Mass 212.00694 InChI InChI=1S/C7H4N2O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H,(H,10,11) InChIKey VYWYYJYRVSBHJQ-UHFFFAOYSA-N SMILES OC(=O)c1cc(cc(c1)[N+]([O-])=O)[N+]([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 3,5-dinitrobenzoic acid (CHEBI:73914) is a C-nitro compound (CHEBI:35716) 3,5-dinitrobenzoic acid (CHEBI:73914) is a benzoic acids (CHEBI:22723) IUPAC Name 3,5-dinitrobenzoic acid Synonyms Sources 3,5-dinitrobenzenecarboxylic acid ChEBI 3,5-DNBA ChEBI 3-carboxy-1,5-dinitrobenzene ChemIDplus dinitrobenzoic acid NIST Chemistry WebBook DNBA NIST Chemistry WebBook Manual Xref Database 3,5-Dinitrobenzoic_acid Wikipedia View more database links Registry Numbers Types Sources 1914286 Reaxys Registry Number Reaxys 99-34-3 CAS Registry Number NIST Chemistry WebBook 99-34-3 CAS Registry Number ChemIDplus Last Modified 04 June 2013