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> Main
CHEBI:25620 - 2-nitrobenzoic acid
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ChEBI Name
2-nitrobenzoic acid
ChEBI ID
CHEBI:25620
Definition
A nitrobenzoic acid carrying the nitro substituent at position 2.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C7H5NO4
Net Charge
0
Average Mass
167.11894
Monoisotopic Mass
167.02186
InChI
InChI=1S/C7H5NO4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H,9,10)
InChIKey
SLAMLWHELXOEJZ-UHFFFAOYSA-N
SMILES
OC(=O)c1ccccc1[N+]([O-])=O
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
2-nitrobenzoic acid (
CHEBI:25620
)
has functional parent
benzoic acid (
CHEBI:30746
)
2-nitrobenzoic acid (
CHEBI:25620
)
is a
nitrobenzoic acid (
CHEBI:25553
)
2-nitrobenzoic acid (
CHEBI:25620
)
is conjugate acid of
2-nitrobenzoate (
CHEBI:25619
)
Incoming
2-nitrobenzoate (
CHEBI:25619
)
is conjugate base of
2-nitrobenzoic acid (
CHEBI:25620
)
IUPAC Name
2-nitrobenzoic acid
Synonyms
Sources
2-Nitrobenzoic acid
KEGG COMPOUND
o-Carboxynitrobenzene
ChemIDplus
o-Nitrobenzoic acid
ChemIDplus
Manual Xrefs
Databases
C16234
KEGG COMPOUND
CPD-9168
MetaCyc
View more database links
Registry Numbers
Types
Sources
1910632
Reaxys Registry Number
Reaxys
552-16-9
CAS Registry Number
ChemIDplus
552-16-9
CAS Registry Number
NIST Chemistry WebBook
Citation
Type
Source
23123905
PubMed citation
Europe PMC
Last Modified
28 July 2014