CHEBI:46171 - 4-acetamidobenzoic acid

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ChEBI Name 4-acetamidobenzoic acid
ChEBI ID CHEBI:46171
Definition A amidobenzoic acid that consists of benzoic acid bearing an acetamido substituent at position 4.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C9H9NO3
Net Charge 0
Average Mass 179.17270
Monoisotopic Mass 179.05824
InChI InChI=1S/C9H9NO3/c1-6(11)10-8-4-2-7(3-5-8)9(12)13/h2-5H,1H3,(H,10,11)(H,12,13)
InChIKey QCXJEYYXVJIFCE-UHFFFAOYSA-N
SMILES CC(=O)Nc1ccc(cc1)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 )
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ChEBI Ontology
Outgoing 4-acetamidobenzoic acid (CHEBI:46171) has functional parent 4-aminobenzoic acid (CHEBI:30753)
4-acetamidobenzoic acid (CHEBI:46171) is a amidobenzoic acid (CHEBI:48470)
4-acetamidobenzoic acid (CHEBI:46171) is conjugate acid of 4-acetamidobenzoate (CHEBI:63815)
Incoming 4-acetamidobenzoate (CHEBI:63815) is conjugate base of 4-acetamidobenzoic acid (CHEBI:46171)
IUPAC Name
4-acetamidobenzoic acid
INNs Sources
acedoben DrugBank
acedobene DrugBank
acedobenum DrugBank
Synonyms Sources
4-(Acetylamino)benzoic acid DrugBank
4-Acetylaminobenzoic acid DrugBank
4-Carboxyacetanilide DrugBank
N-Acetyl-p-aminobenzoic acid DrugBank
N-Acetyl-PABA DrugBank
p-Acetamidobenzoic acid DrugBank
p-Acetoaminobenzoic acid NIST Chemistry WebBook
p-Acetylaminobenzoic acid DrugBank
PARA ACETAMIDO BENZOIC ACID PDBeChem
Manual Xrefs Databases
DB04500 DrugBank
TYZ PDBeChem
View more database links
Registry Numbers Types Sources
390602 Reaxys Registry Number Reaxys
556-08-1 CAS Registry Number NIST Chemistry WebBook
556-08-1 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
11808848 PubMed citation Europe PMC
7585581 PubMed citation Europe PMC
Last Modified
06 February 2012