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CHEBI:231494 - 3-nitrobenzoic acid

ChEBI IDCHEBI:231494
ChEBI Name3-nitrobenzoic acid
Stars
DefinitionA nitrobenzoic acid having the nitro group at the 3-position.
Last Modified30 May 2024
SubmitterAdnan
DownloadsMolfile
FormulaC7H5NO4
Net Charge0
Average Mass167.120
Monoisotopic Mass167.02186
SMILESO=C(O)c1cccc([N+](=O)[O-])c1
InChIInChI=1S/C7H5NO4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H,(H,9,10)
InChIKeyAFPHTEQTJZKQAQ-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)
3-nitrobenzoic acid (CHEBI:231494) is a nitrobenzoic acid (CHEBI:25553)
3-nitrobenzoic acid (CHEBI:231494) is conjugate acid of 3-nitrobenzoate (CHEBI:231488)
Incoming Relation(s)
3-nitrobenzoate (CHEBI:231488) is conjugate base of 3-nitrobenzoic acid (CHEBI:231494)
IUPAC Name 
3-nitrobenzoic acid
Synonyms  Source
m-nitrobenzoic acidChEBI
m-carboxynitrobenzeneChEBI
m-nitrobenzenecarboxylic acidChEBI
Manual XrefsDatabases
3-Nitrobenzoic_acidWikipedia
Registry NumbersSources
Reaxys:908644Reaxys
CAS:121-92-6NIST Chemistry WebBook
Citations